--- _id: '13429' author: - first_name: Adriana full_name: Bocchini, Adriana id: '58349' last_name: Bocchini orcid: https://orcid.org/0000-0002-2134-3075 - first_name: Sergej full_name: Neufeld, Sergej id: '23261' last_name: Neufeld - first_name: Uwe full_name: Gerstmann, Uwe id: '171' last_name: Gerstmann orcid: 0000-0002-4476-223X - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Bocchini A, Neufeld S, Gerstmann U, Schmidt WG. Oxygen and potassium vacancies in KTP calculated from first principles. Journal of Physics: Condensed Matter. 2019;31:385401. doi:10.1088/1361-648x/ab295c' apa: 'Bocchini, A., Neufeld, S., Gerstmann, U., & Schmidt, W. G. (2019). Oxygen and potassium vacancies in KTP calculated from first principles. Journal of Physics: Condensed Matter, 31, 385401. https://doi.org/10.1088/1361-648x/ab295c' bibtex: '@article{Bocchini_Neufeld_Gerstmann_Schmidt_2019, title={Oxygen and potassium vacancies in KTP calculated from first principles}, volume={31}, DOI={10.1088/1361-648x/ab295c}, journal={Journal of Physics: Condensed Matter}, author={Bocchini, Adriana and Neufeld, Sergej and Gerstmann, Uwe and Schmidt, Wolf Gero}, year={2019}, pages={385401} }' chicago: 'Bocchini, Adriana, Sergej Neufeld, Uwe Gerstmann, and Wolf Gero Schmidt. “Oxygen and Potassium Vacancies in KTP Calculated from First Principles.” Journal of Physics: Condensed Matter 31 (2019): 385401. https://doi.org/10.1088/1361-648x/ab295c.' ieee: 'A. Bocchini, S. Neufeld, U. Gerstmann, and W. G. Schmidt, “Oxygen and potassium vacancies in KTP calculated from first principles,” Journal of Physics: Condensed Matter, vol. 31, p. 385401, 2019, doi: 10.1088/1361-648x/ab295c.' mla: 'Bocchini, Adriana, et al. “Oxygen and Potassium Vacancies in KTP Calculated from First Principles.” Journal of Physics: Condensed Matter, vol. 31, 2019, p. 385401, doi:10.1088/1361-648x/ab295c.' short: 'A. Bocchini, S. Neufeld, U. Gerstmann, W.G. Schmidt, Journal of Physics: Condensed Matter 31 (2019) 385401.' date_created: 2019-09-20T12:22:27Z date_updated: 2023-04-21T11:37:48Z department: - _id: '15' - _id: '170' - _id: '295' - _id: '230' - _id: '429' - _id: '35' doi: 10.1088/1361-648x/ab295c intvolume: ' 31' language: - iso: eng main_file_link: - open_access: '1' oa: '1' page: '385401' project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing - _id: '52' name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing' - _id: '53' name: 'TRR 142: TRR 142' - _id: '55' name: 'TRR 142 - B: TRR 142 - Project Area B' - _id: '69' name: 'TRR 142 - B4: TRR 142 - Subproject B4' publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Oxygen and potassium vacancies in KTP calculated from first principles type: journal_article user_id: '171' volume: 31 year: '2019' ... --- _id: '7481' abstract: - lang: eng text: The electronic band structures of hexagonal ZnO and cubic ZnS, ZnSe, and ZnTe compounds are determined within hybrid-density-functional theory and quasiparticle calculations. It is found that the band-edge energies calculated on the G0W0 (Zn chalcogenides) or GW (ZnO) level of theory agree well with experiment, while fully self-consistent QSGW calculations are required for the correct description of the Zn 3d bands. The quasiparticle band structures are used to calculate the linear response and second-harmonic-generation (SHG) spectra of the Zn–VI compounds. Excitonic effects in the optical absorption are accounted for within the Bethe–Salpeter approach. The calculated spectra are discussed in the context of previous experimental data and present SHG measurements for ZnO. article_number: '215702' article_type: original author: - first_name: Arthur full_name: Riefer, Arthur last_name: Riefer - first_name: Nils full_name: Weber, Nils last_name: Weber - first_name: Johannes full_name: Mund, Johannes last_name: Mund - first_name: Dmitri R. full_name: Yakovlev, Dmitri R. last_name: Yakovlev - first_name: Manfred full_name: Bayer, Manfred last_name: Bayer - first_name: Arno full_name: Schindlmayr, Arno id: '458' last_name: Schindlmayr orcid: 0000-0002-4855-071X - first_name: Cedrik full_name: Meier, Cedrik id: '20798' last_name: Meier orcid: https://orcid.org/0000-0002-3787-3572 - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Riefer A, Weber N, Mund J, et al. Zn–VI quasiparticle gaps and optical spectra from many-body calculations. Journal of Physics: Condensed Matter. 2017;29(21). doi:10.1088/1361-648x/aa6b2a' apa: 'Riefer, A., Weber, N., Mund, J., Yakovlev, D. R., Bayer, M., Schindlmayr, A., … Schmidt, W. G. (2017). Zn–VI quasiparticle gaps and optical spectra from many-body calculations. Journal of Physics: Condensed Matter, 29(21). https://doi.org/10.1088/1361-648x/aa6b2a' bibtex: '@article{Riefer_Weber_Mund_Yakovlev_Bayer_Schindlmayr_Meier_Schmidt_2017, title={Zn–VI quasiparticle gaps and optical spectra from many-body calculations}, volume={29}, DOI={10.1088/1361-648x/aa6b2a}, number={21215702}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Riefer, Arthur and Weber, Nils and Mund, Johannes and Yakovlev, Dmitri R. and Bayer, Manfred and Schindlmayr, Arno and Meier, Cedrik and Schmidt, Wolf Gero}, year={2017} }' chicago: 'Riefer, Arthur, Nils Weber, Johannes Mund, Dmitri R. Yakovlev, Manfred Bayer, Arno Schindlmayr, Cedrik Meier, and Wolf Gero Schmidt. “Zn–VI Quasiparticle Gaps and Optical Spectra from Many-Body Calculations.” Journal of Physics: Condensed Matter 29, no. 21 (2017). https://doi.org/10.1088/1361-648x/aa6b2a.' ieee: 'A. Riefer et al., “Zn–VI quasiparticle gaps and optical spectra from many-body calculations,” Journal of Physics: Condensed Matter, vol. 29, no. 21, 2017.' mla: 'Riefer, Arthur, et al. “Zn–VI Quasiparticle Gaps and Optical Spectra from Many-Body Calculations.” Journal of Physics: Condensed Matter, vol. 29, no. 21, 215702, IOP Publishing, 2017, doi:10.1088/1361-648x/aa6b2a.' short: 'A. Riefer, N. Weber, J. Mund, D.R. Yakovlev, M. Bayer, A. Schindlmayr, C. Meier, W.G. Schmidt, Journal of Physics: Condensed Matter 29 (2017).' date_created: 2019-02-04T13:46:58Z date_updated: 2022-01-06T07:03:39Z ddc: - '530' department: - _id: '287' - _id: '295' - _id: '296' - _id: '230' - _id: '429' doi: 10.1088/1361-648x/aa6b2a external_id: isi: - '000400093100001' pmid: - '28374685' file: - access_level: closed content_type: application/pdf creator: schindlm date_created: 2020-08-28T14:01:15Z date_updated: 2020-08-30T14:34:08Z description: © 2017 IOP Publishing Ltd file_id: '18574' file_name: Riefer_2017_J._Phys. _Condens._Matter_29_215702.pdf file_size: 2551657 relation: main_file title: Zn–VI quasiparticle gaps and optical spectra from many-body calculations file_date_updated: 2020-08-30T14:34:08Z has_accepted_license: '1' intvolume: ' 29' isi: '1' issue: '21' language: - iso: eng pmid: '1' project: - _id: '53' name: TRR 142 - _id: '55' name: TRR 142 - Project Area B - _id: '66' name: TRR 142 - Subproject B1 - _id: '69' name: TRR 142 - Subproject B4 - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: eissn: - 1361-648X issn: - 0953-8984 publication_status: published publisher: IOP Publishing quality_controlled: '1' status: public title: Zn–VI quasiparticle gaps and optical spectra from many-body calculations type: journal_article user_id: '458' volume: 29 year: '2017' ... --- _id: '13418' article_number: '413001' author: - first_name: Simone full_name: Sanna, Simone last_name: Sanna - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Sanna S, Schmidt WG. LiNbO3 surfaces from a microscopic perspective. Journal of Physics: Condensed Matter. 2017. doi:10.1088/1361-648x/aa818d' apa: 'Sanna, S., & Schmidt, W. G. (2017). LiNbO3 surfaces from a microscopic perspective. Journal of Physics: Condensed Matter. https://doi.org/10.1088/1361-648x/aa818d' bibtex: '@article{Sanna_Schmidt_2017, title={LiNbO3 surfaces from a microscopic perspective}, DOI={10.1088/1361-648x/aa818d}, number={413001}, journal={Journal of Physics: Condensed Matter}, author={Sanna, Simone and Schmidt, Wolf Gero}, year={2017} }' chicago: 'Sanna, Simone, and Wolf Gero Schmidt. “LiNbO3 Surfaces from a Microscopic Perspective.” Journal of Physics: Condensed Matter, 2017. https://doi.org/10.1088/1361-648x/aa818d.' ieee: 'S. Sanna and W. G. Schmidt, “LiNbO3 surfaces from a microscopic perspective,” Journal of Physics: Condensed Matter, 2017.' mla: 'Sanna, Simone, and Wolf Gero Schmidt. “LiNbO3 Surfaces from a Microscopic Perspective.” Journal of Physics: Condensed Matter, 413001, 2017, doi:10.1088/1361-648x/aa818d.' short: 'S. Sanna, W.G. Schmidt, Journal of Physics: Condensed Matter (2017).' date_created: 2019-09-20T11:59:09Z date_updated: 2022-01-06T06:51:35Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/1361-648x/aa818d funded_apc: '1' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: LiNbO3 surfaces from a microscopic perspective type: journal_article user_id: '16199' year: '2017' ... --- _id: '13803' article_number: '465901' author: - first_name: P full_name: Giannozzi, P last_name: Giannozzi - first_name: O full_name: Andreussi, O last_name: Andreussi - first_name: T full_name: Brumme, T last_name: Brumme - first_name: O full_name: Bunau, O last_name: Bunau - first_name: M full_name: Buongiorno Nardelli, M last_name: Buongiorno Nardelli - first_name: M full_name: Calandra, M last_name: Calandra - first_name: R full_name: Car, R last_name: Car - first_name: C full_name: Cavazzoni, C last_name: Cavazzoni - first_name: D full_name: Ceresoli, D last_name: Ceresoli - first_name: M full_name: Cococcioni, M last_name: Cococcioni - first_name: N full_name: Colonna, N last_name: Colonna - first_name: I full_name: Carnimeo, I last_name: Carnimeo - first_name: A full_name: Dal Corso, A last_name: Dal Corso - first_name: S full_name: de Gironcoli, S last_name: de Gironcoli - first_name: P full_name: Delugas, P last_name: Delugas - first_name: R A full_name: DiStasio, R A last_name: DiStasio - first_name: A full_name: Ferretti, A last_name: Ferretti - first_name: A full_name: Floris, A last_name: Floris - first_name: G full_name: Fratesi, G last_name: Fratesi - first_name: G full_name: Fugallo, G last_name: Fugallo - first_name: R full_name: Gebauer, R last_name: Gebauer - first_name: Uwe full_name: Gerstmann, Uwe id: '171' last_name: Gerstmann - first_name: F full_name: Giustino, F last_name: Giustino - first_name: T full_name: Gorni, T last_name: Gorni - first_name: J full_name: Jia, J last_name: Jia - first_name: M full_name: Kawamura, M last_name: Kawamura - first_name: H-Y full_name: Ko, H-Y last_name: Ko - first_name: A full_name: Kokalj, A last_name: Kokalj - first_name: E full_name: Küçükbenli, E last_name: Küçükbenli - first_name: M full_name: Lazzeri, M last_name: Lazzeri - first_name: M full_name: Marsili, M last_name: Marsili - first_name: N full_name: Marzari, N last_name: Marzari - first_name: F full_name: Mauri, F last_name: Mauri - first_name: N L full_name: Nguyen, N L last_name: Nguyen - first_name: H-V full_name: Nguyen, H-V last_name: Nguyen - first_name: A full_name: Otero-de-la-Roza, A last_name: Otero-de-la-Roza - first_name: L full_name: Paulatto, L last_name: Paulatto - first_name: S full_name: Poncé, S last_name: Poncé - first_name: D full_name: Rocca, D last_name: Rocca - first_name: R full_name: Sabatini, R last_name: Sabatini - first_name: B full_name: Santra, B last_name: Santra - first_name: M full_name: Schlipf, M last_name: Schlipf - first_name: A P full_name: Seitsonen, A P last_name: Seitsonen - first_name: A full_name: Smogunov, A last_name: Smogunov - first_name: I full_name: Timrov, I last_name: Timrov - first_name: T full_name: Thonhauser, T last_name: Thonhauser - first_name: P full_name: Umari, P last_name: Umari - first_name: N full_name: Vast, N last_name: Vast - first_name: X full_name: Wu, X last_name: Wu - first_name: S full_name: Baroni, S last_name: Baroni citation: ama: 'Giannozzi P, Andreussi O, Brumme T, et al. Advanced capabilities for materials modelling with Quantum ESPRESSO. Journal of Physics: Condensed Matter. 2017;29(46). doi:10.1088/1361-648x/aa8f79' apa: 'Giannozzi, P., Andreussi, O., Brumme, T., Bunau, O., Buongiorno Nardelli, M., Calandra, M., … Baroni, S. (2017). Advanced capabilities for materials modelling with Quantum ESPRESSO. Journal of Physics: Condensed Matter, 29(46). https://doi.org/10.1088/1361-648x/aa8f79' bibtex: '@article{Giannozzi_Andreussi_Brumme_Bunau_Buongiorno Nardelli_Calandra_Car_Cavazzoni_Ceresoli_Cococcioni_et al._2017, title={Advanced capabilities for materials modelling with Quantum ESPRESSO}, volume={29}, DOI={10.1088/1361-648x/aa8f79}, number={46465901}, journal={Journal of Physics: Condensed Matter}, author={Giannozzi, P and Andreussi, O and Brumme, T and Bunau, O and Buongiorno Nardelli, M and Calandra, M and Car, R and Cavazzoni, C and Ceresoli, D and Cococcioni, M and et al.}, year={2017} }' chicago: 'Giannozzi, P, O Andreussi, T Brumme, O Bunau, M Buongiorno Nardelli, M Calandra, R Car, et al. “Advanced Capabilities for Materials Modelling with Quantum ESPRESSO.” Journal of Physics: Condensed Matter 29, no. 46 (2017). https://doi.org/10.1088/1361-648x/aa8f79.' ieee: 'P. Giannozzi et al., “Advanced capabilities for materials modelling with Quantum ESPRESSO,” Journal of Physics: Condensed Matter, vol. 29, no. 46, 2017.' mla: 'Giannozzi, P., et al. “Advanced Capabilities for Materials Modelling with Quantum ESPRESSO.” Journal of Physics: Condensed Matter, vol. 29, no. 46, 465901, 2017, doi:10.1088/1361-648x/aa8f79.' short: 'P. Giannozzi, O. Andreussi, T. Brumme, O. Bunau, M. Buongiorno Nardelli, M. Calandra, R. Car, C. Cavazzoni, D. Ceresoli, M. Cococcioni, N. Colonna, I. Carnimeo, A. Dal Corso, S. de Gironcoli, P. Delugas, R.A. DiStasio, A. Ferretti, A. Floris, G. Fratesi, G. Fugallo, R. Gebauer, U. Gerstmann, F. Giustino, T. Gorni, J. Jia, M. Kawamura, H.-Y. Ko, A. Kokalj, E. Küçükbenli, M. Lazzeri, M. Marsili, N. Marzari, F. Mauri, N.L. Nguyen, H.-V. Nguyen, A. Otero-de-la-Roza, L. Paulatto, S. Poncé, D. Rocca, R. Sabatini, B. Santra, M. Schlipf, A.P. Seitsonen, A. Smogunov, I. Timrov, T. Thonhauser, P. Umari, N. Vast, X. Wu, S. Baroni, Journal of Physics: Condensed Matter 29 (2017).' date_created: 2019-10-11T10:45:17Z date_updated: 2022-01-06T06:51:45Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/1361-648x/aa8f79 funded_apc: '1' intvolume: ' 29' issue: '46' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Advanced capabilities for materials modelling with Quantum ESPRESSO type: journal_article user_id: '16199' volume: 29 year: '2017' ... --- _id: '10030' abstract: - lang: eng text: The vibrational properties of stoichiometric LiNbO3 are analyzed within density-functional perturbation theory in order to obtain the complete phonon dispersion of the material. The phonon density of states of the ferroelectric (paraelectric) phase shows two (one) distinct band gaps separating the high-frequency (~800 cm−1) optical branches from the continuum of acoustic and lower optical phonon states. This result leads to specific heat capacites in close agreement with experimental measurements in the range 0–350 K and a Debye temperature of 574 K. The calculated zero-point renormalization of the electronic Kohn–Sham eigenvalues reveals a strong dependence on the phonon wave vectors, especially near Γ. Integrated over all phonon modes, our results indicate a vibrational correction of the electronic band gap of 0.41 eV at 0 K, which is in excellent agreement with the extrapolated temperature-dependent measurements. article_number: '385402' article_type: original author: - first_name: Michael full_name: Friedrich, Michael last_name: Friedrich - first_name: Arthur full_name: Riefer, Arthur last_name: Riefer - first_name: Simone full_name: Sanna, Simone last_name: Sanna - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 - first_name: Arno full_name: Schindlmayr, Arno id: '458' last_name: Schindlmayr orcid: 0000-0002-4855-071X citation: ama: 'Friedrich M, Riefer A, Sanna S, Schmidt WG, Schindlmayr A. Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory. Journal of Physics: Condensed Matter. 2015;27(38). doi:10.1088/0953-8984/27/38/385402' apa: 'Friedrich, M., Riefer, A., Sanna, S., Schmidt, W. G., & Schindlmayr, A. (2015). Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory. Journal of Physics: Condensed Matter, 27(38). https://doi.org/10.1088/0953-8984/27/38/385402' bibtex: '@article{Friedrich_Riefer_Sanna_Schmidt_Schindlmayr_2015, title={Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory}, volume={27}, DOI={10.1088/0953-8984/27/38/385402}, number={38385402}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Friedrich, Michael and Riefer, Arthur and Sanna, Simone and Schmidt, Wolf Gero and Schindlmayr, Arno}, year={2015} }' chicago: 'Friedrich, Michael, Arthur Riefer, Simone Sanna, Wolf Gero Schmidt, and Arno Schindlmayr. “Phonon Dispersion and Zero-Point Renormalization of LiNbO3 from Density-Functional Perturbation Theory.” Journal of Physics: Condensed Matter 27, no. 38 (2015). https://doi.org/10.1088/0953-8984/27/38/385402.' ieee: 'M. Friedrich, A. Riefer, S. Sanna, W. G. Schmidt, and A. Schindlmayr, “Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory,” Journal of Physics: Condensed Matter, vol. 27, no. 38, 2015.' mla: 'Friedrich, Michael, et al. “Phonon Dispersion and Zero-Point Renormalization of LiNbO3 from Density-Functional Perturbation Theory.” Journal of Physics: Condensed Matter, vol. 27, no. 38, 385402, IOP Publishing, 2015, doi:10.1088/0953-8984/27/38/385402.' short: 'M. Friedrich, A. Riefer, S. Sanna, W.G. Schmidt, A. Schindlmayr, Journal of Physics: Condensed Matter 27 (2015).' date_created: 2019-05-29T08:41:18Z date_updated: 2022-01-06T06:50:27Z ddc: - '530' department: - _id: '295' - _id: '296' - _id: '230' - _id: '429' doi: 10.1088/0953-8984/27/38/385402 external_id: isi: - '000362549700004' pmid: - '26337951' file: - access_level: closed content_type: application/pdf creator: schindlm date_created: 2020-08-28T14:24:23Z date_updated: 2020-08-30T14:46:56Z description: © 2015 IOP Publishing Ltd file_id: '18578' file_name: Friedrich_2015_J._Phys. _Condens._Matter_27_385402.pdf file_size: 1793430 relation: main_file title: Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory file_date_updated: 2020-08-30T14:46:56Z has_accepted_license: '1' intvolume: ' 27' isi: '1' issue: '38' language: - iso: eng pmid: '1' project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing - _id: '53' name: TRR 142 - _id: '55' name: TRR 142 - Project Area B - _id: '69' name: TRR 142 - Subproject B4 publication: 'Journal of Physics: Condensed Matter' publication_identifier: eissn: - 1361-648X issn: - 0953-8984 publication_status: published publisher: IOP Publishing quality_controlled: '1' status: public title: Phonon dispersion and zero-point renormalization of LiNbO3 from density-functional perturbation theory type: journal_article user_id: '458' volume: 27 year: '2015' ... --- _id: '13922' article_number: '445501' author: - first_name: Hong full_name: Liu, Hong last_name: Liu - first_name: Dirk Florian full_name: Heinze, Dirk Florian id: '10904' last_name: Heinze - first_name: Huynh full_name: Thanh Duc, Huynh last_name: Thanh Duc - first_name: Stefan full_name: Schumacher, Stefan id: '27271' last_name: Schumacher orcid: 0000-0003-4042-4951 - first_name: Torsten full_name: Meier, Torsten id: '344' last_name: Meier orcid: 0000-0001-8864-2072 citation: ama: 'Liu H, Heinze DF, Thanh Duc H, Schumacher S, Meier T. Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter. 2015;27(44). doi:10.1088/0953-8984/27/44/445501' apa: 'Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., & Meier, T. (2015). Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter, 27(44), Article 445501. https://doi.org/10.1088/0953-8984/27/44/445501' bibtex: '@article{Liu_Heinze_Thanh Duc_Schumacher_Meier_2015, title={Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling}, volume={27}, DOI={10.1088/0953-8984/27/44/445501}, number={44445501}, journal={Journal of Physics: Condensed Matter}, author={Liu, Hong and Heinze, Dirk Florian and Thanh Duc, Huynh and Schumacher, Stefan and Meier, Torsten}, year={2015} }' chicago: 'Liu, Hong, Dirk Florian Heinze, Huynh Thanh Duc, Stefan Schumacher, and Torsten Meier. “Curvature Effects in the Band Structure of Carbon Nanotubes Including Spin–Orbit Coupling.” Journal of Physics: Condensed Matter 27, no. 44 (2015). https://doi.org/10.1088/0953-8984/27/44/445501.' ieee: 'H. Liu, D. F. Heinze, H. Thanh Duc, S. Schumacher, and T. Meier, “Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling,” Journal of Physics: Condensed Matter, vol. 27, no. 44, Art. no. 445501, 2015, doi: 10.1088/0953-8984/27/44/445501.' mla: 'Liu, Hong, et al. “Curvature Effects in the Band Structure of Carbon Nanotubes Including Spin–Orbit Coupling.” Journal of Physics: Condensed Matter, vol. 27, no. 44, 445501, 2015, doi:10.1088/0953-8984/27/44/445501.' short: 'H. Liu, D.F. Heinze, H. Thanh Duc, S. Schumacher, T. Meier, Journal of Physics: Condensed Matter 27 (2015).' date_created: 2019-10-18T08:55:01Z date_updated: 2023-03-26T21:11:50Z department: - _id: '15' - _id: '170' - _id: '293' - _id: '297' - _id: '230' doi: 10.1088/0953-8984/27/44/445501 funded_apc: '1' intvolume: ' 27' issue: '44' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing - _id: '52' name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing' publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling type: journal_article user_id: '49063' volume: 27 year: '2015' ... --- _id: '22946' abstract: - lang: eng text: The Kane–Mele model was previously used to describe effective spin–orbit couplings (SOCs) in graphene. Here we extend this model and also incorporate curvature effects to analyze the combined influence of SOC and curvature on the band structure of carbon nanotubes (CNTs). The extended model then reproduces the chirality-dependent asymmetric electron-hole splitting for semiconducting CNTs and in the band structure for metallic CNTs shows an opening of the band gap and a change of the Fermi wave vector with spin. For chiral semiconducting CNTs with large chiral angle we show that the spin-splitting configuration of bands near the Fermi energy depends on the value of $\text{mod}(2n+m,3)$ . article_number: '445501' author: - first_name: Hong full_name: Liu, Hong last_name: Liu - first_name: Dirk Florian full_name: Heinze, Dirk Florian id: '10904' last_name: Heinze - first_name: Huynh full_name: Thanh Duc, Huynh last_name: Thanh Duc - first_name: Stefan full_name: Schumacher, Stefan id: '27271' last_name: Schumacher orcid: 0000-0003-4042-4951 - first_name: Torsten full_name: Meier, Torsten id: '344' last_name: Meier orcid: 0000-0001-8864-2072 citation: ama: 'Liu H, Heinze DF, Thanh Duc H, Schumacher S, Meier T. Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter. 2015;27(44). doi:10.1088/0953-8984/27/44/445501' apa: 'Liu, H., Heinze, D. F., Thanh Duc, H., Schumacher, S., & Meier, T. (2015). Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling. Journal of Physics: Condensed Matter, 27(44), Article 445501. https://doi.org/10.1088/0953-8984/27/44/445501' bibtex: '@article{Liu_Heinze_Thanh Duc_Schumacher_Meier_2015, title={Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling}, volume={27}, DOI={10.1088/0953-8984/27/44/445501}, number={44445501}, journal={Journal of Physics: Condensed Matter}, author={Liu, Hong and Heinze, Dirk Florian and Thanh Duc, Huynh and Schumacher, Stefan and Meier, Torsten}, year={2015} }' chicago: 'Liu, Hong, Dirk Florian Heinze, Huynh Thanh Duc, Stefan Schumacher, and Torsten Meier. “Curvature Effects in the Band Structure of Carbon Nanotubes Including Spin–Orbit Coupling.” Journal of Physics: Condensed Matter 27, no. 44 (2015). https://doi.org/10.1088/0953-8984/27/44/445501.' ieee: 'H. Liu, D. F. Heinze, H. Thanh Duc, S. Schumacher, and T. Meier, “Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling,” Journal of Physics: Condensed Matter, vol. 27, no. 44, Art. no. 445501, 2015, doi: 10.1088/0953-8984/27/44/445501.' mla: 'Liu, Hong, et al. “Curvature Effects in the Band Structure of Carbon Nanotubes Including Spin–Orbit Coupling.” Journal of Physics: Condensed Matter, vol. 27, no. 44, 445501, 2015, doi:10.1088/0953-8984/27/44/445501.' short: 'H. Liu, D.F. Heinze, H. Thanh Duc, S. Schumacher, T. Meier, Journal of Physics: Condensed Matter 27 (2015).' date_created: 2021-08-06T08:49:10Z date_updated: 2023-04-16T21:25:28Z department: - _id: '15' - _id: '170' - _id: '293' - _id: '297' - _id: '230' doi: 10.1088/0953-8984/27/44/445501 intvolume: ' 27' issue: '44' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing - _id: '52' name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing' publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Curvature effects in the band structure of carbon nanotubes including spin–orbit coupling type: journal_article user_id: '49063' volume: 27 year: '2015' ... --- _id: '13511' article_number: '253201' author: - first_name: M full_name: Landmann, M last_name: Landmann - first_name: T full_name: Köhler, T last_name: Köhler - first_name: E full_name: Rauls, E last_name: Rauls - first_name: T full_name: Frauenheim, T last_name: Frauenheim - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Landmann M, Köhler T, Rauls E, Frauenheim T, Schmidt WG. The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides. Journal of Physics: Condensed Matter. 2014;26. doi:10.1088/0953-8984/26/25/253201' apa: 'Landmann, M., Köhler, T., Rauls, E., Frauenheim, T., & Schmidt, W. G. (2014). The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides. Journal of Physics: Condensed Matter, 26. https://doi.org/10.1088/0953-8984/26/25/253201' bibtex: '@article{Landmann_Köhler_Rauls_Frauenheim_Schmidt_2014, title={The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides}, volume={26}, DOI={10.1088/0953-8984/26/25/253201}, number={253201}, journal={Journal of Physics: Condensed Matter}, author={Landmann, M and Köhler, T and Rauls, E and Frauenheim, T and Schmidt, Wolf Gero}, year={2014} }' chicago: 'Landmann, M, T Köhler, E Rauls, T Frauenheim, and Wolf Gero Schmidt. “The Atomic Structure of Ternary Amorphous TixSi1−xO2hybrid Oxides.” Journal of Physics: Condensed Matter 26 (2014). https://doi.org/10.1088/0953-8984/26/25/253201.' ieee: 'M. Landmann, T. Köhler, E. Rauls, T. Frauenheim, and W. G. Schmidt, “The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides,” Journal of Physics: Condensed Matter, vol. 26, 2014.' mla: 'Landmann, M., et al. “The Atomic Structure of Ternary Amorphous TixSi1−xO2hybrid Oxides.” Journal of Physics: Condensed Matter, vol. 26, 253201, 2014, doi:10.1088/0953-8984/26/25/253201.' short: 'M. Landmann, T. Köhler, E. Rauls, T. Frauenheim, W.G. Schmidt, Journal of Physics: Condensed Matter 26 (2014).' date_created: 2019-09-30T13:31:47Z date_updated: 2022-01-06T06:51:37Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/0953-8984/26/25/253201 intvolume: ' 26' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: The atomic structure of ternary amorphous TixSi1−xO2hybrid oxides type: journal_article user_id: '16199' volume: 26 year: '2014' ... --- _id: '7260' article_number: '325304' author: - first_name: D J full_name: Carrad, D J last_name: Carrad - first_name: A M full_name: Burke, A M last_name: Burke - first_name: P J full_name: Reece, P J last_name: Reece - first_name: R W full_name: Lyttleton, R W last_name: Lyttleton - first_name: D E J full_name: Waddington, D E J last_name: Waddington - first_name: A full_name: Rai, A last_name: Rai - first_name: Dirk full_name: Reuter, Dirk id: '37763' last_name: Reuter - first_name: A D full_name: Wieck, A D last_name: Wieck - first_name: A P full_name: Micolich, A P last_name: Micolich citation: ama: 'Carrad DJ, Burke AM, Reece PJ, et al. The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices. Journal of Physics: Condensed Matter. 2013;25(32). doi:10.1088/0953-8984/25/32/325304' apa: 'Carrad, D. J., Burke, A. M., Reece, P. J., Lyttleton, R. W., Waddington, D. E. J., Rai, A., … Micolich, A. P. (2013). The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices. Journal of Physics: Condensed Matter, 25(32). https://doi.org/10.1088/0953-8984/25/32/325304' bibtex: '@article{Carrad_Burke_Reece_Lyttleton_Waddington_Rai_Reuter_Wieck_Micolich_2013, title={The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices}, volume={25}, DOI={10.1088/0953-8984/25/32/325304}, number={32325304}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Carrad, D J and Burke, A M and Reece, P J and Lyttleton, R W and Waddington, D E J and Rai, A and Reuter, Dirk and Wieck, A D and Micolich, A P}, year={2013} }' chicago: 'Carrad, D J, A M Burke, P J Reece, R W Lyttleton, D E J Waddington, A Rai, Dirk Reuter, A D Wieck, and A P Micolich. “The Effect of (NH4)2Sxpassivation on the (311)A GaAs Surface and Its Use in AlGaAs/GaAs Heterostructure Devices.” Journal of Physics: Condensed Matter 25, no. 32 (2013). https://doi.org/10.1088/0953-8984/25/32/325304.' ieee: 'D. J. Carrad et al., “The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices,” Journal of Physics: Condensed Matter, vol. 25, no. 32, 2013.' mla: 'Carrad, D. J., et al. “The Effect of (NH4)2Sxpassivation on the (311)A GaAs Surface and Its Use in AlGaAs/GaAs Heterostructure Devices.” Journal of Physics: Condensed Matter, vol. 25, no. 32, 325304, IOP Publishing, 2013, doi:10.1088/0953-8984/25/32/325304.' short: 'D.J. Carrad, A.M. Burke, P.J. Reece, R.W. Lyttleton, D.E.J. Waddington, A. Rai, D. Reuter, A.D. Wieck, A.P. Micolich, Journal of Physics: Condensed Matter 25 (2013).' date_created: 2019-01-30T12:57:16Z date_updated: 2022-01-06T07:03:31Z department: - _id: '15' - _id: '230' doi: 10.1088/0953-8984/25/32/325304 intvolume: ' 25' issue: '32' language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published publisher: IOP Publishing status: public title: The effect of (NH4)2Sxpassivation on the (311)A GaAs surface and its use in AlGaAs/GaAs heterostructure devices type: journal_article user_id: '42514' volume: 25 year: '2013' ... --- _id: '4111' abstract: - lang: eng text: "In this article we study the elemental distribution and solute solubility in nanocrystalline alloys of immiscible components near restricted equilibrium for the case of the binary Cu–Ag system. As predicted from thermodynamic considerations, a grain boundary segregated monophase alloy is observed in the annealed mechanically alloyed state for low Ag content by using atom probe tomography. From the detected Ag solute grain boundary enrichment the\r\nsegregation free enthalpy is estimated to range between -25 and -49 kJ mol^-1 following the McLean equation, in agreement with values reported for coarse-grained Cu–Ag. The extension of the alloying range is described by a two-domain thermodynamic model that considers the excess free volume in the grain boundaries and the strain in the strain interior on the basis of the universal equation of state at negative pressure. To access the grain boundary volumetric strain experimentally, a method based on a combination of density measurements and microscopical quantification of closed pore areas is presented. Moreover, we apply x-ray diffraction line broadening analysis to determine the local strain amplitude, which yields a root-mean-square microstrain of \x180.3% for a grain size of \x1830 nm. It is shown that the grain boundary free volume represents the major origin for the global solubility enhancement in\r\nnanocrystalline Cu–Ag at 503 K." article_number: 115401 (9 pp.) article_type: original author: - first_name: Thomas full_name: Riedl, Thomas id: '36950' last_name: Riedl - first_name: A full_name: Kirchner, A last_name: Kirchner - first_name: K full_name: Eymann, K last_name: Eymann - first_name: A full_name: Shariq, A last_name: Shariq - first_name: R full_name: Schlesiger, R last_name: Schlesiger - first_name: G full_name: Schmitz, G last_name: Schmitz - first_name: M full_name: Ruhnow, M last_name: Ruhnow - first_name: B full_name: Kieback, B last_name: Kieback citation: ama: 'Riedl T, Kirchner A, Eymann K, et al. Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys. Journal of Physics: Condensed Matter. 2013;25(11). doi:10.1088/0953-8984/25/11/115401' apa: 'Riedl, T., Kirchner, A., Eymann, K., Shariq, A., Schlesiger, R., Schmitz, G., … Kieback, B. (2013). Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys. Journal of Physics: Condensed Matter, 25(11). https://doi.org/10.1088/0953-8984/25/11/115401' bibtex: '@article{Riedl_Kirchner_Eymann_Shariq_Schlesiger_Schmitz_Ruhnow_Kieback_2013, title={Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys}, volume={25}, DOI={10.1088/0953-8984/25/11/115401}, number={11115401 (9 pp.)}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Riedl, Thomas and Kirchner, A and Eymann, K and Shariq, A and Schlesiger, R and Schmitz, G and Ruhnow, M and Kieback, B}, year={2013} }' chicago: 'Riedl, Thomas, A Kirchner, K Eymann, A Shariq, R Schlesiger, G Schmitz, M Ruhnow, and B Kieback. “Elemental Distribution, Solute Solubility and Defect Free Volume in Nanocrystalline Restricted-Equilibrium Cu–Ag Alloys.” Journal of Physics: Condensed Matter 25, no. 11 (2013). https://doi.org/10.1088/0953-8984/25/11/115401.' ieee: 'T. Riedl et al., “Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys,” Journal of Physics: Condensed Matter, vol. 25, no. 11, 2013.' mla: 'Riedl, Thomas, et al. “Elemental Distribution, Solute Solubility and Defect Free Volume in Nanocrystalline Restricted-Equilibrium Cu–Ag Alloys.” Journal of Physics: Condensed Matter, vol. 25, no. 11, 115401 (9 pp.), IOP Publishing, 2013, doi:10.1088/0953-8984/25/11/115401.' short: 'T. Riedl, A. Kirchner, K. Eymann, A. Shariq, R. Schlesiger, G. Schmitz, M. Ruhnow, B. Kieback, Journal of Physics: Condensed Matter 25 (2013).' date_created: 2018-08-23T13:18:34Z date_updated: 2022-01-06T07:00:18Z ddc: - '530' department: - _id: '15' - _id: '286' doi: 10.1088/0953-8984/25/11/115401 file: - access_level: closed content_type: application/pdf creator: hclaudia date_created: 2018-08-23T13:21:21Z date_updated: 2018-08-23T13:21:21Z file_id: '4112' file_name: Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu-Ag alloys.pdf file_size: 1116530 relation: main_file success: 1 file_date_updated: 2018-08-23T13:21:21Z has_accepted_license: '1' intvolume: ' 25' issue: '11' language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published publisher: IOP Publishing status: public title: Elemental distribution, solute solubility and defect free volume in nanocrystalline restricted-equilibrium Cu–Ag alloys type: journal_article user_id: '55706' volume: 25 year: '2013' ... --- _id: '18542' abstract: - lang: eng text: 'We present recent advances in numerical implementations of hybrid functionals and the GW approximation within the full-potential linearized augmented-plane-wave (FLAPW) method. The former is an approximation for the exchange–correlation contribution to the total energy functional in density-functional theory, and the latter is an approximation for the electronic self-energy in the framework of many-body perturbation theory. All implementations employ the mixed product basis, which has evolved into a versatile basis for the products of wave functions, describing the incoming and outgoing states of an electron that is scattered by interacting with another electron. It can thus be used for representing the nonlocal potential in hybrid functionals as well as the screened interaction and related quantities in GW calculations. In particular, the six-dimensional space integrals of the Hamiltonian exchange matrix elements (and exchange self-energy) decompose into sums over vector–matrix–vector products, which can be evaluated easily. The correlation part of the GW self-energy, which contains a time or frequency dependence, is calculated on the imaginary frequency axis with a subsequent analytic continuation to the real axis or, alternatively, by a direct frequency convolution of the Green function G and the dynamically screened Coulomb interaction W along a contour integration path that avoids the poles of the Green function. Hybrid-functional and GW calculations are notoriously computationally expensive. We present a number of tricks that reduce the computational cost considerably, including the use of spatial and time-reversal symmetries, modifications of the mixed product basis with the aim to optimize it for the correlation self-energy and another modification that makes the Coulomb matrix sparse, analytic expansions of the interaction potentials around the point of divergence at k=0, and a nested density and density-matrix convergence scheme for hybrid-functional calculations. We show CPU timings for prototype semiconductors and illustrative results for GdN and ZnO. ' article_number: '293201' article_type: review author: - first_name: Christoph full_name: Friedrich, Christoph last_name: Friedrich - first_name: Markus full_name: Betzinger, Markus last_name: Betzinger - first_name: Martin full_name: Schlipf, Martin last_name: Schlipf - first_name: Stefan full_name: Blügel, Stefan last_name: Blügel - first_name: Arno full_name: Schindlmayr, Arno id: '458' last_name: Schindlmayr orcid: 0000-0002-4855-071X citation: ama: 'Friedrich C, Betzinger M, Schlipf M, Blügel S, Schindlmayr A. Hybrid functionals and GW approximation in the FLAPW method. Journal of Physics: Condensed Matter. 2012;24(29). doi:10.1088/0953-8984/24/29/293201' apa: 'Friedrich, C., Betzinger, M., Schlipf, M., Blügel, S., & Schindlmayr, A. (2012). Hybrid functionals and GW approximation in the FLAPW method. Journal of Physics: Condensed Matter, 24(29). https://doi.org/10.1088/0953-8984/24/29/293201' bibtex: '@article{Friedrich_Betzinger_Schlipf_Blügel_Schindlmayr_2012, title={Hybrid functionals and GW approximation in the FLAPW method}, volume={24}, DOI={10.1088/0953-8984/24/29/293201}, number={29293201}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Friedrich, Christoph and Betzinger, Markus and Schlipf, Martin and Blügel, Stefan and Schindlmayr, Arno}, year={2012} }' chicago: 'Friedrich, Christoph, Markus Betzinger, Martin Schlipf, Stefan Blügel, and Arno Schindlmayr. “Hybrid Functionals and GW Approximation in the FLAPW Method.” Journal of Physics: Condensed Matter 24, no. 29 (2012). https://doi.org/10.1088/0953-8984/24/29/293201.' ieee: 'C. Friedrich, M. Betzinger, M. Schlipf, S. Blügel, and A. Schindlmayr, “Hybrid functionals and GW approximation in the FLAPW method,” Journal of Physics: Condensed Matter, vol. 24, no. 29, 2012.' mla: 'Friedrich, Christoph, et al. “Hybrid Functionals and GW Approximation in the FLAPW Method.” Journal of Physics: Condensed Matter, vol. 24, no. 29, 293201, IOP Publishing, 2012, doi:10.1088/0953-8984/24/29/293201.' short: 'C. Friedrich, M. Betzinger, M. Schlipf, S. Blügel, A. Schindlmayr, Journal of Physics: Condensed Matter 24 (2012).' date_created: 2020-08-28T10:14:44Z date_updated: 2022-01-06T06:53:37Z ddc: - '530' department: - _id: '296' doi: 10.1088/0953-8984/24/29/293201 external_id: isi: - '000306270700001' pmid: - '22773268' file: - access_level: closed content_type: application/pdf creator: schindlm date_created: 2020-08-28T14:30:29Z date_updated: 2020-08-30T15:00:14Z description: © 2012 IOP Publishing Ltd file_id: '18580' file_name: Friedrich_2012_J._Phys. _Condens._Matter_24_293201.pdf file_size: 1059896 relation: main_file title: Hybrid functionals and GW approximation in the FLAPW method file_date_updated: 2020-08-30T15:00:14Z has_accepted_license: '1' intvolume: ' 24' isi: '1' issue: '29' language: - iso: eng pmid: '1' publication: 'Journal of Physics: Condensed Matter' publication_identifier: eissn: - 1361-648X issn: - 0953-8984 publication_status: published publisher: IOP Publishing quality_controlled: '1' status: public title: Hybrid functionals and GW approximation in the FLAPW method type: journal_article user_id: '458' volume: 24 year: '2012' ... --- _id: '7325' article_number: '165801' author: - first_name: J full_name: Schuster, J last_name: Schuster - first_name: T Y full_name: Kim, T Y last_name: Kim - first_name: E full_name: Batke, E last_name: Batke - first_name: Dirk full_name: Reuter, Dirk id: '37763' last_name: Reuter - first_name: A D full_name: Wieck, A D last_name: Wieck citation: ama: 'Schuster J, Kim TY, Batke E, Reuter D, Wieck AD. Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures. Journal of Physics: Condensed Matter. 2012;24(16). doi:10.1088/0953-8984/24/16/165801' apa: 'Schuster, J., Kim, T. Y., Batke, E., Reuter, D., & Wieck, A. D. (2012). Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures. Journal of Physics: Condensed Matter, 24(16). https://doi.org/10.1088/0953-8984/24/16/165801' bibtex: '@article{Schuster_Kim_Batke_Reuter_Wieck_2012, title={Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures}, volume={24}, DOI={10.1088/0953-8984/24/16/165801}, number={16165801}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Schuster, J and Kim, T Y and Batke, E and Reuter, Dirk and Wieck, A D}, year={2012} }' chicago: 'Schuster, J, T Y Kim, E Batke, Dirk Reuter, and A D Wieck. “Photoluminescence Lineshape Features of Carbon δ-Doped GaAs Heterostructures.” Journal of Physics: Condensed Matter 24, no. 16 (2012). https://doi.org/10.1088/0953-8984/24/16/165801.' ieee: 'J. Schuster, T. Y. Kim, E. Batke, D. Reuter, and A. D. Wieck, “Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures,” Journal of Physics: Condensed Matter, vol. 24, no. 16, 2012.' mla: 'Schuster, J., et al. “Photoluminescence Lineshape Features of Carbon δ-Doped GaAs Heterostructures.” Journal of Physics: Condensed Matter, vol. 24, no. 16, 165801, IOP Publishing, 2012, doi:10.1088/0953-8984/24/16/165801.' short: 'J. Schuster, T.Y. Kim, E. Batke, D. Reuter, A.D. Wieck, Journal of Physics: Condensed Matter 24 (2012).' date_created: 2019-01-31T10:53:35Z date_updated: 2022-01-06T07:03:35Z department: - _id: '15' - _id: '230' doi: 10.1088/0953-8984/24/16/165801 intvolume: ' 24' issue: '16' language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published publisher: IOP Publishing status: public title: Photoluminescence lineshape features of carbon δ-doped GaAs heterostructures type: journal_article user_id: '42514' volume: 24 year: '2012' ... --- _id: '13545' article_number: '195503' author: - first_name: M full_name: Landmann, M last_name: Landmann - first_name: E full_name: Rauls, E last_name: Rauls - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Landmann M, Rauls E, Schmidt WG. The electronic structure and optical response of rutile, anatase and brookite TiO2. Journal of Physics: Condensed Matter. 2012;24. doi:10.1088/0953-8984/24/19/195503' apa: 'Landmann, M., Rauls, E., & Schmidt, W. G. (2012). The electronic structure and optical response of rutile, anatase and brookite TiO2. Journal of Physics: Condensed Matter, 24. https://doi.org/10.1088/0953-8984/24/19/195503' bibtex: '@article{Landmann_Rauls_Schmidt_2012, title={The electronic structure and optical response of rutile, anatase and brookite TiO2}, volume={24}, DOI={10.1088/0953-8984/24/19/195503}, number={195503}, journal={Journal of Physics: Condensed Matter}, author={Landmann, M and Rauls, E and Schmidt, Wolf Gero}, year={2012} }' chicago: 'Landmann, M, E Rauls, and Wolf Gero Schmidt. “The Electronic Structure and Optical Response of Rutile, Anatase and Brookite TiO2.” Journal of Physics: Condensed Matter 24 (2012). https://doi.org/10.1088/0953-8984/24/19/195503.' ieee: 'M. Landmann, E. Rauls, and W. G. Schmidt, “The electronic structure and optical response of rutile, anatase and brookite TiO2,” Journal of Physics: Condensed Matter, vol. 24, 2012.' mla: 'Landmann, M., et al. “The Electronic Structure and Optical Response of Rutile, Anatase and Brookite TiO2.” Journal of Physics: Condensed Matter, vol. 24, 195503, 2012, doi:10.1088/0953-8984/24/19/195503.' short: 'M. Landmann, E. Rauls, W.G. Schmidt, Journal of Physics: Condensed Matter 24 (2012).' date_created: 2019-09-30T14:51:40Z date_updated: 2022-01-06T06:51:38Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/0953-8984/24/19/195503 intvolume: ' 24' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: The electronic structure and optical response of rutile, anatase and brookite TiO2 type: journal_article user_id: '16199' volume: 24 year: '2012' ... --- _id: '29677' article_number: '266001' author: - first_name: Andreas full_name: Helmstedt, Andreas last_name: Helmstedt - first_name: Norbert full_name: Müller, Norbert last_name: Müller - first_name: Aaron full_name: Gryzia, Aaron last_name: Gryzia - first_name: Niklas full_name: Dohmeier, Niklas last_name: Dohmeier - first_name: Armin full_name: Brechling, Armin last_name: Brechling - first_name: Marc full_name: Sacher, Marc id: '26883' last_name: Sacher - first_name: Ulrich full_name: Heinzmann, Ulrich last_name: Heinzmann - first_name: Veronika full_name: Hoeke, Veronika last_name: Hoeke - first_name: Erich full_name: Krickemeyer, Erich last_name: Krickemeyer - first_name: Thorsten full_name: Glaser, Thorsten last_name: Glaser - first_name: Samuel full_name: Bouvron, Samuel last_name: Bouvron - first_name: Mikhail full_name: Fonin, Mikhail last_name: Fonin - first_name: Manfred full_name: Neumann, Manfred last_name: Neumann citation: ama: 'Helmstedt A, Müller N, Gryzia A, et al. Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers. Journal of Physics: Condensed Matter. 2011;23(26). doi:10.1088/0953-8984/23/26/266001' apa: 'Helmstedt, A., Müller, N., Gryzia, A., Dohmeier, N., Brechling, A., Sacher, M., Heinzmann, U., Hoeke, V., Krickemeyer, E., Glaser, T., Bouvron, S., Fonin, M., & Neumann, M. (2011). Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers. Journal of Physics: Condensed Matter, 23(26), Article 266001. https://doi.org/10.1088/0953-8984/23/26/266001' bibtex: '@article{Helmstedt_Müller_Gryzia_Dohmeier_Brechling_Sacher_Heinzmann_Hoeke_Krickemeyer_Glaser_et al._2011, title={Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers}, volume={23}, DOI={10.1088/0953-8984/23/26/266001}, number={26266001}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Helmstedt, Andreas and Müller, Norbert and Gryzia, Aaron and Dohmeier, Niklas and Brechling, Armin and Sacher, Marc and Heinzmann, Ulrich and Hoeke, Veronika and Krickemeyer, Erich and Glaser, Thorsten and et al.}, year={2011} }' chicago: 'Helmstedt, Andreas, Norbert Müller, Aaron Gryzia, Niklas Dohmeier, Armin Brechling, Marc Sacher, Ulrich Heinzmann, et al. “Spin Resolved Photoelectron Spectroscopy of [Mn6IIICrIII]3 +single-Molecule Magnets and of Manganese Compounds as Reference Layers.” Journal of Physics: Condensed Matter 23, no. 26 (2011). https://doi.org/10.1088/0953-8984/23/26/266001.' ieee: 'A. Helmstedt et al., “Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers,” Journal of Physics: Condensed Matter, vol. 23, no. 26, Art. no. 266001, 2011, doi: 10.1088/0953-8984/23/26/266001.' mla: 'Helmstedt, Andreas, et al. “Spin Resolved Photoelectron Spectroscopy of [Mn6IIICrIII]3 +single-Molecule Magnets and of Manganese Compounds as Reference Layers.” Journal of Physics: Condensed Matter, vol. 23, no. 26, 266001, IOP Publishing, 2011, doi:10.1088/0953-8984/23/26/266001.' short: 'A. Helmstedt, N. Müller, A. Gryzia, N. Dohmeier, A. Brechling, M. Sacher, U. Heinzmann, V. Hoeke, E. Krickemeyer, T. Glaser, S. Bouvron, M. Fonin, M. Neumann, Journal of Physics: Condensed Matter 23 (2011).' date_created: 2022-01-31T10:11:42Z date_updated: 2022-01-31T10:12:14Z department: - _id: '15' - _id: '576' doi: 10.1088/0953-8984/23/26/266001 extern: '1' intvolume: ' 23' issue: '26' keyword: - Condensed Matter Physics - General Materials Science language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published publisher: IOP Publishing status: public title: Spin resolved photoelectron spectroscopy of [Mn6IIICrIII]3 +single-molecule magnets and of manganese compounds as reference layers type: journal_article user_id: '26883' volume: 23 year: '2011' ... --- _id: '13662' article_number: '185001' author: - first_name: S full_name: Blankenburg, S last_name: Blankenburg - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Blankenburg S, Schmidt WG. Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions. Journal of Physics: Condensed Matter. 2009;21. doi:10.1088/0953-8984/21/18/185001' apa: 'Blankenburg, S., & Schmidt, W. G. (2009). Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions. Journal of Physics: Condensed Matter, 21. https://doi.org/10.1088/0953-8984/21/18/185001' bibtex: '@article{Blankenburg_Schmidt_2009, title={Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions}, volume={21}, DOI={10.1088/0953-8984/21/18/185001}, number={185001}, journal={Journal of Physics: Condensed Matter}, author={Blankenburg, S and Schmidt, Wolf Gero}, year={2009} }' chicago: 'Blankenburg, S, and Wolf Gero Schmidt. “Glutamic Acid Adsorbed on Ag(110): Direct and Indirect Molecular Interactions.” Journal of Physics: Condensed Matter 21 (2009). https://doi.org/10.1088/0953-8984/21/18/185001.' ieee: 'S. Blankenburg and W. G. Schmidt, “Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions,” Journal of Physics: Condensed Matter, vol. 21, 2009.' mla: 'Blankenburg, S., and Wolf Gero Schmidt. “Glutamic Acid Adsorbed on Ag(110): Direct and Indirect Molecular Interactions.” Journal of Physics: Condensed Matter, vol. 21, 185001, 2009, doi:10.1088/0953-8984/21/18/185001.' short: 'S. Blankenburg, W.G. Schmidt, Journal of Physics: Condensed Matter 21 (2009).' date_created: 2019-10-09T09:12:29Z date_updated: 2022-01-06T06:51:41Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/0953-8984/21/18/185001 funded_apc: '1' intvolume: ' 21' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: 'Glutamic acid adsorbed on Ag(110): direct and indirect molecular interactions' type: journal_article user_id: '16199' volume: 21 year: '2009' ... --- _id: '13802' article_number: '395502' author: - first_name: Paolo full_name: Giannozzi, Paolo last_name: Giannozzi - first_name: Stefano full_name: Baroni, Stefano last_name: Baroni - first_name: Nicola full_name: Bonini, Nicola last_name: Bonini - first_name: Matteo full_name: Calandra, Matteo last_name: Calandra - first_name: Roberto full_name: Car, Roberto last_name: Car - first_name: Carlo full_name: Cavazzoni, Carlo last_name: Cavazzoni - first_name: Davide full_name: Ceresoli, Davide last_name: Ceresoli - first_name: Guido L full_name: Chiarotti, Guido L last_name: Chiarotti - first_name: Matteo full_name: Cococcioni, Matteo last_name: Cococcioni - first_name: Ismaila full_name: Dabo, Ismaila last_name: Dabo - first_name: Andrea full_name: Dal Corso, Andrea last_name: Dal Corso - first_name: Stefano full_name: de Gironcoli, Stefano last_name: de Gironcoli - first_name: Stefano full_name: Fabris, Stefano last_name: Fabris - first_name: Guido full_name: Fratesi, Guido last_name: Fratesi - first_name: Ralph full_name: Gebauer, Ralph last_name: Gebauer - first_name: Uwe full_name: Gerstmann, Uwe id: '171' last_name: Gerstmann - first_name: Christos full_name: Gougoussis, Christos last_name: Gougoussis - first_name: Anton full_name: Kokalj, Anton last_name: Kokalj - first_name: Michele full_name: Lazzeri, Michele last_name: Lazzeri - first_name: Layla full_name: Martin-Samos, Layla last_name: Martin-Samos - first_name: Nicola full_name: Marzari, Nicola last_name: Marzari - first_name: Francesco full_name: Mauri, Francesco last_name: Mauri - first_name: Riccardo full_name: Mazzarello, Riccardo last_name: Mazzarello - first_name: Stefano full_name: Paolini, Stefano last_name: Paolini - first_name: Alfredo full_name: Pasquarello, Alfredo last_name: Pasquarello - first_name: Lorenzo full_name: Paulatto, Lorenzo last_name: Paulatto - first_name: Carlo full_name: Sbraccia, Carlo last_name: Sbraccia - first_name: Sandro full_name: Scandolo, Sandro last_name: Scandolo - first_name: Gabriele full_name: Sclauzero, Gabriele last_name: Sclauzero - first_name: Ari P full_name: Seitsonen, Ari P last_name: Seitsonen - first_name: Alexander full_name: Smogunov, Alexander last_name: Smogunov - first_name: Paolo full_name: Umari, Paolo last_name: Umari - first_name: Renata M full_name: Wentzcovitch, Renata M last_name: Wentzcovitch citation: ama: 'Giannozzi P, Baroni S, Bonini N, et al. QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of Physics: Condensed Matter. 2009;21(39). doi:10.1088/0953-8984/21/39/395502' apa: 'Giannozzi, P., Baroni, S., Bonini, N., Calandra, M., Car, R., Cavazzoni, C., … Wentzcovitch, R. M. (2009). QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials. Journal of Physics: Condensed Matter, 21(39). https://doi.org/10.1088/0953-8984/21/39/395502' bibtex: '@article{Giannozzi_Baroni_Bonini_Calandra_Car_Cavazzoni_Ceresoli_Chiarotti_Cococcioni_Dabo_et al._2009, title={QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials}, volume={21}, DOI={10.1088/0953-8984/21/39/395502}, number={39395502}, journal={Journal of Physics: Condensed Matter}, author={Giannozzi, Paolo and Baroni, Stefano and Bonini, Nicola and Calandra, Matteo and Car, Roberto and Cavazzoni, Carlo and Ceresoli, Davide and Chiarotti, Guido L and Cococcioni, Matteo and Dabo, Ismaila and et al.}, year={2009} }' chicago: 'Giannozzi, Paolo, Stefano Baroni, Nicola Bonini, Matteo Calandra, Roberto Car, Carlo Cavazzoni, Davide Ceresoli, et al. “QUANTUM ESPRESSO: A Modular and Open-Source Software Project for Quantum Simulations of Materials.” Journal of Physics: Condensed Matter 21, no. 39 (2009). https://doi.org/10.1088/0953-8984/21/39/395502.' ieee: 'P. Giannozzi et al., “QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials,” Journal of Physics: Condensed Matter, vol. 21, no. 39, 2009.' mla: 'Giannozzi, Paolo, et al. “QUANTUM ESPRESSO: A Modular and Open-Source Software Project for Quantum Simulations of Materials.” Journal of Physics: Condensed Matter, vol. 21, no. 39, 395502, 2009, doi:10.1088/0953-8984/21/39/395502.' short: 'P. Giannozzi, S. Baroni, N. Bonini, M. Calandra, R. Car, C. Cavazzoni, D. Ceresoli, G.L. Chiarotti, M. Cococcioni, I. Dabo, A. Dal Corso, S. de Gironcoli, S. Fabris, G. Fratesi, R. Gebauer, U. Gerstmann, C. Gougoussis, A. Kokalj, M. Lazzeri, L. Martin-Samos, N. Marzari, F. Mauri, R. Mazzarello, S. Paolini, A. Pasquarello, L. Paulatto, C. Sbraccia, S. Scandolo, G. Sclauzero, A.P. Seitsonen, A. Smogunov, P. Umari, R.M. Wentzcovitch, Journal of Physics: Condensed Matter 21 (2009).' date_created: 2019-10-11T10:42:39Z date_updated: 2022-01-06T06:51:45Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/0953-8984/21/39/395502 funded_apc: '1' intvolume: ' 21' issue: '39' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: 'QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials' type: journal_article user_id: '16199' volume: 21 year: '2009' ... --- _id: '4557' abstract: - lang: eng text: The optical properties of semiconductor quantum dots are in many respects similar to those of atoms. Since quantum dots can be defined by state-of-the-art semiconductor technologies, they exhibit long-term stability and allow for well-controlled and efficient interactions with both optical and electrical fields. Resonant ps excitation of single quantum dot photodiodes leads to new classes of coherent optoelectronic functions and devices, which exhibit precise state preparation, phase-sensitive optical manipulations and the control of quantum states by electrical fields. article_number: '454210' article_type: original author: - first_name: Artur full_name: Zrenner, Artur id: '606' last_name: Zrenner orcid: 0000-0002-5190-0944 - first_name: P full_name: Ester, P last_name: Ester - first_name: S full_name: Michaelis de Vasconcellos, S last_name: Michaelis de Vasconcellos - first_name: M C full_name: Hübner, M C last_name: Hübner - first_name: L full_name: Lackmann, L last_name: Lackmann - first_name: S full_name: Stufler, S last_name: Stufler - first_name: M full_name: Bichler, M last_name: Bichler citation: ama: 'Zrenner A, Ester P, Michaelis de Vasconcellos S, et al. Coherent optoelectronics with single quantum dots. Journal of Physics: Condensed Matter. 2008;20(45). doi:10.1088/0953-8984/20/45/454210' apa: 'Zrenner, A., Ester, P., Michaelis de Vasconcellos, S., Hübner, M. C., Lackmann, L., Stufler, S., & Bichler, M. (2008). Coherent optoelectronics with single quantum dots. Journal of Physics: Condensed Matter, 20(45). https://doi.org/10.1088/0953-8984/20/45/454210' bibtex: '@article{Zrenner_Ester_Michaelis de Vasconcellos_Hübner_Lackmann_Stufler_Bichler_2008, title={Coherent optoelectronics with single quantum dots}, volume={20}, DOI={10.1088/0953-8984/20/45/454210}, number={45454210}, journal={Journal of Physics: Condensed Matter}, publisher={IOP Publishing}, author={Zrenner, Artur and Ester, P and Michaelis de Vasconcellos, S and Hübner, M C and Lackmann, L and Stufler, S and Bichler, M}, year={2008} }' chicago: 'Zrenner, Artur, P Ester, S Michaelis de Vasconcellos, M C Hübner, L Lackmann, S Stufler, and M Bichler. “Coherent Optoelectronics with Single Quantum Dots.” Journal of Physics: Condensed Matter 20, no. 45 (2008). https://doi.org/10.1088/0953-8984/20/45/454210.' ieee: 'A. Zrenner et al., “Coherent optoelectronics with single quantum dots,” Journal of Physics: Condensed Matter, vol. 20, no. 45, 2008.' mla: 'Zrenner, Artur, et al. “Coherent Optoelectronics with Single Quantum Dots.” Journal of Physics: Condensed Matter, vol. 20, no. 45, 454210, IOP Publishing, 2008, doi:10.1088/0953-8984/20/45/454210.' short: 'A. Zrenner, P. Ester, S. Michaelis de Vasconcellos, M.C. Hübner, L. Lackmann, S. Stufler, M. Bichler, Journal of Physics: Condensed Matter 20 (2008).' date_created: 2018-09-20T13:51:11Z date_updated: 2022-01-06T07:01:09Z department: - _id: '15' - _id: '230' - _id: '35' doi: 10.1088/0953-8984/20/45/454210 intvolume: ' 20' issue: '45' language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published publisher: IOP Publishing status: public title: Coherent optoelectronics with single quantum dots type: journal_article user_id: '49428' volume: 20 year: '2008' ... --- _id: '8616' article_number: '374108' author: - first_name: F J full_name: Kaiser, F J last_name: Kaiser - first_name: S full_name: Kohler, S last_name: Kohler - first_name: P full_name: Hänggi, P last_name: Hänggi - first_name: M full_name: Malecha, M last_name: Malecha - first_name: J full_name: Ebbecke, J last_name: Ebbecke - first_name: A full_name: Wixforth, A last_name: Wixforth - first_name: H W full_name: Schumacher, H W last_name: Schumacher - first_name: B full_name: Kästner, B last_name: Kästner - first_name: Dirk full_name: Reuter, Dirk id: '37763' last_name: Reuter - first_name: A D full_name: Wieck, A D last_name: Wieck citation: ama: 'Kaiser FJ, Kohler S, Hänggi P, et al. Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems. Journal of Physics: Condensed Matter. 2008. doi:10.1088/0953-8984/20/37/374108' apa: 'Kaiser, F. J., Kohler, S., Hänggi, P., Malecha, M., Ebbecke, J., Wixforth, A., … Wieck, A. D. (2008). Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems. Journal of Physics: Condensed Matter. https://doi.org/10.1088/0953-8984/20/37/374108' bibtex: '@article{Kaiser_Kohler_Hänggi_Malecha_Ebbecke_Wixforth_Schumacher_Kästner_Reuter_Wieck_2008, title={Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems}, DOI={10.1088/0953-8984/20/37/374108}, number={374108}, journal={Journal of Physics: Condensed Matter}, author={Kaiser, F J and Kohler, S and Hänggi, P and Malecha, M and Ebbecke, J and Wixforth, A and Schumacher, H W and Kästner, B and Reuter, Dirk and Wieck, A D}, year={2008} }' chicago: 'Kaiser, F J, S Kohler, P Hänggi, M Malecha, J Ebbecke, A Wixforth, H W Schumacher, B Kästner, Dirk Reuter, and A D Wieck. “Theoretical and Experimental Investigations of Coulomb Blockade in Coupled Quantum Dot Systems.” Journal of Physics: Condensed Matter, 2008. https://doi.org/10.1088/0953-8984/20/37/374108.' ieee: 'F. J. Kaiser et al., “Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems,” Journal of Physics: Condensed Matter, 2008.' mla: 'Kaiser, F. J., et al. “Theoretical and Experimental Investigations of Coulomb Blockade in Coupled Quantum Dot Systems.” Journal of Physics: Condensed Matter, 374108, 2008, doi:10.1088/0953-8984/20/37/374108.' short: 'F.J. Kaiser, S. Kohler, P. Hänggi, M. Malecha, J. Ebbecke, A. Wixforth, H.W. Schumacher, B. Kästner, D. Reuter, A.D. Wieck, Journal of Physics: Condensed Matter (2008).' date_created: 2019-03-26T10:06:37Z date_updated: 2022-01-06T07:03:57Z department: - _id: '15' - _id: '230' doi: 10.1088/0953-8984/20/37/374108 language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Theoretical and experimental investigations of Coulomb blockade in coupled quantum dot systems type: journal_article user_id: '42514' year: '2008' ... --- _id: '13672' article_number: '225003' author: - first_name: A full_name: Hermann, A last_name: Hermann - first_name: P full_name: Schwerdtfeger, P last_name: Schwerdtfeger - first_name: Wolf Gero full_name: Schmidt, Wolf Gero id: '468' last_name: Schmidt orcid: 0000-0002-2717-5076 citation: ama: 'Hermann A, Schwerdtfeger P, Schmidt WG. Theoretical study of the localization of excess electrons at the surface of ice. Journal of Physics: Condensed Matter. 2008;20. doi:10.1088/0953-8984/20/22/225003' apa: 'Hermann, A., Schwerdtfeger, P., & Schmidt, W. G. (2008). Theoretical study of the localization of excess electrons at the surface of ice. Journal of Physics: Condensed Matter, 20. https://doi.org/10.1088/0953-8984/20/22/225003' bibtex: '@article{Hermann_Schwerdtfeger_Schmidt_2008, title={Theoretical study of the localization of excess electrons at the surface of ice}, volume={20}, DOI={10.1088/0953-8984/20/22/225003}, number={225003}, journal={Journal of Physics: Condensed Matter}, author={Hermann, A and Schwerdtfeger, P and Schmidt, Wolf Gero}, year={2008} }' chicago: 'Hermann, A, P Schwerdtfeger, and Wolf Gero Schmidt. “Theoretical Study of the Localization of Excess Electrons at the Surface of Ice.” Journal of Physics: Condensed Matter 20 (2008). https://doi.org/10.1088/0953-8984/20/22/225003.' ieee: 'A. Hermann, P. Schwerdtfeger, and W. G. Schmidt, “Theoretical study of the localization of excess electrons at the surface of ice,” Journal of Physics: Condensed Matter, vol. 20, 2008.' mla: 'Hermann, A., et al. “Theoretical Study of the Localization of Excess Electrons at the Surface of Ice.” Journal of Physics: Condensed Matter, vol. 20, 225003, 2008, doi:10.1088/0953-8984/20/22/225003.' short: 'A. Hermann, P. Schwerdtfeger, W.G. Schmidt, Journal of Physics: Condensed Matter 20 (2008).' date_created: 2019-10-09T09:34:43Z date_updated: 2022-01-06T06:51:41Z department: - _id: '15' - _id: '170' - _id: '295' doi: 10.1088/0953-8984/20/22/225003 intvolume: ' 20' language: - iso: eng project: - _id: '52' name: Computing Resources Provided by the Paderborn Center for Parallel Computing publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Theoretical study of the localization of excess electrons at the surface of ice type: journal_article user_id: '16199' volume: 20 year: '2008' ... --- _id: '8629' article_number: '295206' author: - first_name: A full_name: Pugžlys, A last_name: Pugžlys - first_name: P J full_name: Rizo, P J last_name: Rizo - first_name: K full_name: Ivanin, K last_name: Ivanin - first_name: A full_name: Slachter, A last_name: Slachter - first_name: Dirk full_name: Reuter, Dirk id: '37763' last_name: Reuter - first_name: A D full_name: Wieck, A D last_name: Wieck - first_name: C H van der full_name: Wal, C H van der last_name: Wal - first_name: P H M van full_name: Loosdrecht, P H M van last_name: Loosdrecht citation: ama: 'Pugžlys A, Rizo PJ, Ivanin K, et al. Charge and spin dynamics in a two-dimensional electron gas. Journal of Physics: Condensed Matter. 2007. doi:10.1088/0953-8984/19/29/295206' apa: 'Pugžlys, A., Rizo, P. J., Ivanin, K., Slachter, A., Reuter, D., Wieck, A. D., … Loosdrecht, P. H. M. van. (2007). Charge and spin dynamics in a two-dimensional electron gas. Journal of Physics: Condensed Matter. https://doi.org/10.1088/0953-8984/19/29/295206' bibtex: '@article{Pugžlys_Rizo_Ivanin_Slachter_Reuter_Wieck_Wal_Loosdrecht_2007, title={Charge and spin dynamics in a two-dimensional electron gas}, DOI={10.1088/0953-8984/19/29/295206}, number={295206}, journal={Journal of Physics: Condensed Matter}, author={Pugžlys, A and Rizo, P J and Ivanin, K and Slachter, A and Reuter, Dirk and Wieck, A D and Wal, C H van der and Loosdrecht, P H M van}, year={2007} }' chicago: 'Pugžlys, A, P J Rizo, K Ivanin, A Slachter, Dirk Reuter, A D Wieck, C H van der Wal, and P H M van Loosdrecht. “Charge and Spin Dynamics in a Two-Dimensional Electron Gas.” Journal of Physics: Condensed Matter, 2007. https://doi.org/10.1088/0953-8984/19/29/295206.' ieee: 'A. Pugžlys et al., “Charge and spin dynamics in a two-dimensional electron gas,” Journal of Physics: Condensed Matter, 2007.' mla: 'Pugžlys, A., et al. “Charge and Spin Dynamics in a Two-Dimensional Electron Gas.” Journal of Physics: Condensed Matter, 295206, 2007, doi:10.1088/0953-8984/19/29/295206.' short: 'A. Pugžlys, P.J. Rizo, K. Ivanin, A. Slachter, D. Reuter, A.D. Wieck, C.H. van der Wal, P.H.M. van Loosdrecht, Journal of Physics: Condensed Matter (2007).' date_created: 2019-03-26T10:22:13Z date_updated: 2022-01-06T07:03:57Z department: - _id: '15' - _id: '230' doi: 10.1088/0953-8984/19/29/295206 language: - iso: eng publication: 'Journal of Physics: Condensed Matter' publication_identifier: issn: - 0953-8984 - 1361-648X publication_status: published status: public title: Charge and spin dynamics in a two-dimensional electron gas type: journal_article user_id: '42514' year: '2007' ...