---
_id: '60298'
abstract:
- lang: eng
  text: In this work, we introduce PHOENIX, a highly optimized explicit open-source
    solver for two-dimensional nonlinear Schrödinger equations with extensions. The
    nonlinear Schrödinger equation and its extensions (Gross-Pitaevskii equation)
    are widely studied to model and analyze complex phenomena in fields such as optics,
    condensed matter physics, fluid dynamics, and plasma physics. It serves as a powerful
    tool for understanding nonlinear wave dynamics, soliton formation, and the interplay
    between nonlinearity, dispersion, and diffraction. By extending the nonlinear
    Schrödinger equation, various physical effects such as non-Hermiticity, spin-orbit
    interaction, and quantum optical aspects can be incorporated. PHOENIX is designed
    to accommodate a wide range of applications by a straightforward extendability
    without the need for user knowledge of computing architectures or performance
    optimization. The high performance and power efficiency of PHOENIX are demonstrated
    on a wide range of entry-class to high-end consumer and high-performance computing
    GPUs and CPUs. Compared to a more conventional MATLAB implementation, a speedup
    of up to three orders of magnitude and energy savings of up to 99.8% are achieved.
    The performance is compared to a performance model showing that PHOENIX performs
    close to the relevant performance bounds in many situations. The possibilities
    of PHOENIX are demonstrated with a range of practical examples from the realm
    of nonlinear (quantum) photonics in planar microresonators with active media including
    exciton-polariton condensates. Examples range from solutions on very large grids,
    the use of local optimization algorithms, to Monte Carlo ensemble evolutions with
    quantum noise enabling the tomography of the system's quantum state.
article_number: '109689'
article_type: original
author:
- first_name: Jan
  full_name: Wingenbach, Jan
  id: '69187'
  last_name: Wingenbach
- first_name: David
  full_name: Bauch, David
  id: '44172'
  last_name: Bauch
- first_name: Xuekai
  full_name: Ma, Xuekai
  id: '59416'
  last_name: Ma
- first_name: Robert
  full_name: Schade, Robert
  id: '75963'
  last_name: Schade
  orcid: 0000-0002-6268-5397
- first_name: Christian
  full_name: Plessl, Christian
  id: '16153'
  last_name: Plessl
  orcid: 0000-0001-5728-9982
- first_name: Stefan
  full_name: Schumacher, Stefan
  id: '27271'
  last_name: Schumacher
  orcid: 0000-0003-4042-4951
citation:
  ama: Wingenbach J, Bauch D, Ma X, Schade R, Plessl C, Schumacher S. PHOENIX – Paderborn
    highly optimized and energy efficient solver for two-dimensional nonlinear Schrödinger
    equations with integrated extensions. <i>Computer Physics Communications</i>.
    2025;315. doi:<a href="https://doi.org/10.1016/j.cpc.2025.109689">10.1016/j.cpc.2025.109689</a>
  apa: Wingenbach, J., Bauch, D., Ma, X., Schade, R., Plessl, C., &#38; Schumacher,
    S. (2025). PHOENIX – Paderborn highly optimized and energy efficient solver for
    two-dimensional nonlinear Schrödinger equations with integrated extensions. <i>Computer
    Physics Communications</i>, <i>315</i>, Article 109689. <a href="https://doi.org/10.1016/j.cpc.2025.109689">https://doi.org/10.1016/j.cpc.2025.109689</a>
  bibtex: '@article{Wingenbach_Bauch_Ma_Schade_Plessl_Schumacher_2025, title={PHOENIX
    – Paderborn highly optimized and energy efficient solver for two-dimensional nonlinear
    Schrödinger equations with integrated extensions}, volume={315}, DOI={<a href="https://doi.org/10.1016/j.cpc.2025.109689">10.1016/j.cpc.2025.109689</a>},
    number={109689}, journal={Computer Physics Communications}, publisher={Elsevier
    BV}, author={Wingenbach, Jan and Bauch, David and Ma, Xuekai and Schade, Robert
    and Plessl, Christian and Schumacher, Stefan}, year={2025} }'
  chicago: Wingenbach, Jan, David Bauch, Xuekai Ma, Robert Schade, Christian Plessl,
    and Stefan Schumacher. “PHOENIX – Paderborn Highly Optimized and Energy Efficient
    Solver for Two-Dimensional Nonlinear Schrödinger Equations with Integrated Extensions.”
    <i>Computer Physics Communications</i> 315 (2025). <a href="https://doi.org/10.1016/j.cpc.2025.109689">https://doi.org/10.1016/j.cpc.2025.109689</a>.
  ieee: 'J. Wingenbach, D. Bauch, X. Ma, R. Schade, C. Plessl, and S. Schumacher,
    “PHOENIX – Paderborn highly optimized and energy efficient solver for two-dimensional
    nonlinear Schrödinger equations with integrated extensions,” <i>Computer Physics
    Communications</i>, vol. 315, Art. no. 109689, 2025, doi: <a href="https://doi.org/10.1016/j.cpc.2025.109689">10.1016/j.cpc.2025.109689</a>.'
  mla: Wingenbach, Jan, et al. “PHOENIX – Paderborn Highly Optimized and Energy Efficient
    Solver for Two-Dimensional Nonlinear Schrödinger Equations with Integrated Extensions.”
    <i>Computer Physics Communications</i>, vol. 315, 109689, Elsevier BV, 2025, doi:<a
    href="https://doi.org/10.1016/j.cpc.2025.109689">10.1016/j.cpc.2025.109689</a>.
  short: J. Wingenbach, D. Bauch, X. Ma, R. Schade, C. Plessl, S. Schumacher, Computer
    Physics Communications 315 (2025).
date_created: 2025-06-23T07:38:52Z
date_updated: 2025-06-29T12:00:36Z
department:
- _id: '27'
doi: 10.1016/j.cpc.2025.109689
intvolume: '       315'
language:
- iso: eng
project:
- _id: '52'
  name: 'PC2: Computing Resources Provided by the Paderborn Center for Parallel Computing'
publication: Computer Physics Communications
publication_identifier:
  issn:
  - 0010-4655
publication_status: published
publisher: Elsevier BV
status: public
title: PHOENIX – Paderborn highly optimized and energy efficient solver for two-dimensional
  nonlinear Schrödinger equations with integrated extensions
type: journal_article
user_id: '75963'
volume: 315
year: '2025'
...
---
_id: '23597'
author:
- first_name: Venkat
  full_name: Kapil, Venkat
  last_name: Kapil
- first_name: Mariana
  full_name: Rossi, Mariana
  last_name: Rossi
- first_name: Ondrej
  full_name: Marsalek, Ondrej
  last_name: Marsalek
- first_name: Riccardo
  full_name: Petraglia, Riccardo
  last_name: Petraglia
- first_name: Yair
  full_name: Litman, Yair
  last_name: Litman
- first_name: Thomas
  full_name: Spura, Thomas
  last_name: Spura
- first_name: Bingqing
  full_name: Cheng, Bingqing
  last_name: Cheng
- first_name: Alice
  full_name: Cuzzocrea, Alice
  last_name: Cuzzocrea
- first_name: Robert H.
  full_name: Meißner, Robert H.
  last_name: Meißner
- first_name: David M.
  full_name: Wilkins, David M.
  last_name: Wilkins
- first_name: Benjamin A.
  full_name: Helfrecht, Benjamin A.
  last_name: Helfrecht
- first_name: Przemysław
  full_name: Juda, Przemysław
  last_name: Juda
- first_name: Sébastien P.
  full_name: Bienvenue, Sébastien P.
  last_name: Bienvenue
- first_name: Wei
  full_name: Fang, Wei
  last_name: Fang
- first_name: Jan
  full_name: Kessler, Jan
  last_name: Kessler
- first_name: Igor
  full_name: Poltavsky, Igor
  last_name: Poltavsky
- first_name: Steven
  full_name: Vandenbrande, Steven
  last_name: Vandenbrande
- first_name: Jelle
  full_name: Wieme, Jelle
  last_name: Wieme
- first_name: Clemence
  full_name: Corminboeuf, Clemence
  last_name: Corminboeuf
- first_name: Thomas D.
  full_name: Kühne, Thomas D.
  last_name: Kühne
- first_name: David E.
  full_name: Manolopoulos, David E.
  last_name: Manolopoulos
- first_name: Thomas E.
  full_name: Markland, Thomas E.
  last_name: Markland
- first_name: Jeremy O.
  full_name: Richardson, Jeremy O.
  last_name: Richardson
- first_name: Alexandre
  full_name: Tkatchenko, Alexandre
  last_name: Tkatchenko
- first_name: Gareth A.
  full_name: Tribello, Gareth A.
  last_name: Tribello
- first_name: Veronique
  full_name: Van Speybroeck, Veronique
  last_name: Van Speybroeck
- first_name: Michele
  full_name: Ceriotti, Michele
  last_name: Ceriotti
citation:
  ama: 'Kapil V, Rossi M, Marsalek O, et al. i-PI 2.0: A universal force engine for
    advanced molecular simulations. <i>Computer Physics Communications</i>. 2018:214-223.
    doi:<a href="https://doi.org/10.1016/j.cpc.2018.09.020">10.1016/j.cpc.2018.09.020</a>'
  apa: 'Kapil, V., Rossi, M., Marsalek, O., Petraglia, R., Litman, Y., Spura, T.,
    … Ceriotti, M. (2018). i-PI 2.0: A universal force engine for advanced molecular
    simulations. <i>Computer Physics Communications</i>, 214–223. <a href="https://doi.org/10.1016/j.cpc.2018.09.020">https://doi.org/10.1016/j.cpc.2018.09.020</a>'
  bibtex: '@article{Kapil_Rossi_Marsalek_Petraglia_Litman_Spura_Cheng_Cuzzocrea_Meißner_Wilkins_et
    al._2018, title={i-PI 2.0: A universal force engine for advanced molecular simulations},
    DOI={<a href="https://doi.org/10.1016/j.cpc.2018.09.020">10.1016/j.cpc.2018.09.020</a>},
    journal={Computer Physics Communications}, author={Kapil, Venkat and Rossi, Mariana
    and Marsalek, Ondrej and Petraglia, Riccardo and Litman, Yair and Spura, Thomas
    and Cheng, Bingqing and Cuzzocrea, Alice and Meißner, Robert H. and Wilkins, David
    M. and et al.}, year={2018}, pages={214–223} }'
  chicago: 'Kapil, Venkat, Mariana Rossi, Ondrej Marsalek, Riccardo Petraglia, Yair
    Litman, Thomas Spura, Bingqing Cheng, et al. “I-PI 2.0: A Universal Force Engine
    for Advanced Molecular Simulations.” <i>Computer Physics Communications</i>, 2018,
    214–23. <a href="https://doi.org/10.1016/j.cpc.2018.09.020">https://doi.org/10.1016/j.cpc.2018.09.020</a>.'
  ieee: 'V. Kapil <i>et al.</i>, “i-PI 2.0: A universal force engine for advanced
    molecular simulations,” <i>Computer Physics Communications</i>, pp. 214–223, 2018.'
  mla: 'Kapil, Venkat, et al. “I-PI 2.0: A Universal Force Engine for Advanced Molecular
    Simulations.” <i>Computer Physics Communications</i>, 2018, pp. 214–23, doi:<a
    href="https://doi.org/10.1016/j.cpc.2018.09.020">10.1016/j.cpc.2018.09.020</a>.'
  short: V. Kapil, M. Rossi, O. Marsalek, R. Petraglia, Y. Litman, T. Spura, B. Cheng,
    A. Cuzzocrea, R.H. Meißner, D.M. Wilkins, B.A. Helfrecht, P. Juda, S.P. Bienvenue,
    W. Fang, J. Kessler, I. Poltavsky, S. Vandenbrande, J. Wieme, C. Corminboeuf,
    T.D. Kühne, D.E. Manolopoulos, T.E. Markland, J.O. Richardson, A. Tkatchenko,
    G.A. Tribello, V. Van Speybroeck, M. Ceriotti, Computer Physics Communications
    (2018) 214–223.
date_created: 2021-09-01T09:03:51Z
date_updated: 2022-01-06T06:55:57Z
doi: 10.1016/j.cpc.2018.09.020
language:
- iso: eng
page: 214-223
publication: Computer Physics Communications
publication_identifier:
  issn:
  - 0010-4655
publication_status: published
status: public
title: 'i-PI 2.0: A universal force engine for advanced molecular simulations'
type: journal_article
user_id: '65425'
year: '2018'
...
---
_id: '13276'
author:
- first_name: Gábor
  full_name: Rutkai, Gábor
  last_name: Rutkai
- first_name: Andreas
  full_name: Köster, Andreas
  last_name: Köster
- first_name: Gabriela
  full_name: Guevara-Carrion, Gabriela
  last_name: Guevara-Carrion
- first_name: Tatjana
  full_name: Janzen, Tatjana
  last_name: Janzen
- first_name: Michael
  full_name: Schappals, Michael
  last_name: Schappals
- first_name: Colin W.
  full_name: Glass, Colin W.
  last_name: Glass
- first_name: Martin
  full_name: Bernreuther, Martin
  last_name: Bernreuther
- first_name: Amer
  full_name: Wafai, Amer
  last_name: Wafai
- first_name: Simon
  full_name: Stephan, Simon
  last_name: Stephan
- first_name: Maximilian
  full_name: Kohns, Maximilian
  last_name: Kohns
- first_name: Steffen
  full_name: Reiser, Steffen
  last_name: Reiser
- first_name: Stephan
  full_name: Deublein, Stephan
  last_name: Deublein
- first_name: Martin
  full_name: Horsch, Martin
  last_name: Horsch
- first_name: Hans
  full_name: Hasse, Hans
  last_name: Hasse
- first_name: Jadran
  full_name: Vrabec, Jadran
  last_name: Vrabec
citation:
  ama: 'Rutkai G, Köster A, Guevara-Carrion G, et al. ms2: A Molecular Simulation
    Tool for Thermodynamic Properties, Release 3.0. <i>Computer Physics Communications</i>.
    2017;221:343-351. doi:<a href="https://doi.org/10.1016/j.cpc.2017.07.025">10.1016/j.cpc.2017.07.025</a>'
  apa: 'Rutkai, G., Köster, A., Guevara-Carrion, G., Janzen, T., Schappals, M., Glass,
    C. W., … Vrabec, J. (2017). ms2: A Molecular Simulation Tool for Thermodynamic
    Properties, Release 3.0. <i>Computer Physics Communications</i>, <i>221</i>, 343–351.
    <a href="https://doi.org/10.1016/j.cpc.2017.07.025">https://doi.org/10.1016/j.cpc.2017.07.025</a>'
  bibtex: '@article{Rutkai_Köster_Guevara-Carrion_Janzen_Schappals_Glass_Bernreuther_Wafai_Stephan_Kohns_et
    al._2017, title={ms2: A Molecular Simulation Tool for Thermodynamic Properties,
    Release 3.0}, volume={221}, DOI={<a href="https://doi.org/10.1016/j.cpc.2017.07.025">10.1016/j.cpc.2017.07.025</a>},
    journal={Computer Physics Communications}, author={Rutkai, Gábor and Köster, Andreas
    and Guevara-Carrion, Gabriela and Janzen, Tatjana and Schappals, Michael and Glass,
    Colin W. and Bernreuther, Martin and Wafai, Amer and Stephan, Simon and Kohns,
    Maximilian and et al.}, year={2017}, pages={343–351} }'
  chicago: 'Rutkai, Gábor, Andreas Köster, Gabriela Guevara-Carrion, Tatjana Janzen,
    Michael Schappals, Colin W. Glass, Martin Bernreuther, et al. “Ms2: A Molecular
    Simulation Tool for Thermodynamic Properties, Release 3.0.” <i>Computer Physics
    Communications</i> 221 (2017): 343–51. <a href="https://doi.org/10.1016/j.cpc.2017.07.025">https://doi.org/10.1016/j.cpc.2017.07.025</a>.'
  ieee: 'G. Rutkai <i>et al.</i>, “ms2: A Molecular Simulation Tool for Thermodynamic
    Properties, Release 3.0,” <i>Computer Physics Communications</i>, vol. 221, pp.
    343–351, 2017.'
  mla: 'Rutkai, Gábor, et al. “Ms2: A Molecular Simulation Tool for Thermodynamic
    Properties, Release 3.0.” <i>Computer Physics Communications</i>, vol. 221, 2017,
    pp. 343–51, doi:<a href="https://doi.org/10.1016/j.cpc.2017.07.025">10.1016/j.cpc.2017.07.025</a>.'
  short: G. Rutkai, A. Köster, G. Guevara-Carrion, T. Janzen, M. Schappals, C.W. Glass,
    M. Bernreuther, A. Wafai, S. Stephan, M. Kohns, S. Reiser, S. Deublein, M. Horsch,
    H. Hasse, J. Vrabec, Computer Physics Communications 221 (2017) 343–351.
date_created: 2019-09-18T08:50:35Z
date_updated: 2022-01-06T06:51:31Z
doi: 10.1016/j.cpc.2017.07.025
intvolume: '       221'
language:
- iso: eng
page: 343-351
project:
- _id: '52'
  name: Computing Resources Provided by the Paderborn Center for Parallel Computing
publication: Computer Physics Communications
publication_identifier:
  issn:
  - 0010-4655
publication_status: published
status: public
title: 'ms2: A Molecular Simulation Tool for Thermodynamic Properties, Release 3.0'
type: journal_article
user_id: '40778'
volume: 221
year: '2017'
...
---
_id: '18636'
abstract:
- lang: eng
  text: We derive formulas for the Coulomb matrix within the full-potential linearized
    augmented-plane-wave (FLAPW) method. The Coulomb matrix is a central ingredient
    in implementations of many-body perturbation theory, such as the Hartree–Fock
    and GW approximations for the electronic self-energy or the random-phase approximation
    for the dielectric function. It is represented in the mixed product basis, which
    combines numerical muffin-tin functions and interstitial plane waves constructed
    from products of FLAPW basis functions. The interstitial plane waves are here
    expanded with the Rayleigh formula. The resulting algorithm is very efficient
    in terms of both computational cost and accuracy and is superior to an implementation
    with the Fourier transform of the step function. In order to allow an analytic
    treatment of the divergence at k=0 in reciprocal space, we expand the Coulomb
    matrix analytically around this point without resorting to a projection onto plane
    waves. Without additional approximations, we then apply a basis transformation
    that diagonalizes the Coulomb matrix and confines the divergence to a single eigenvalue.
    At the same time, response matrices like the dielectric function separate into
    head, wings, and body with the same mathematical properties as in a plane-wave
    basis. As an illustration we apply the formulas to electron-energy-loss spectra
    (EELS) for nickel at different k vectors including k=0. The convergence of the
    spectra towards the result at k=0 is clearly seen. Our all-electron treatment
    also allows to include transitions from 3s and 3p core states in the EELS spectrum
    that give rise to a shallow peak at high energies and lead to good agreement with
    experiment.
article_type: original
author:
- first_name: Christoph
  full_name: Friedrich, Christoph
  last_name: Friedrich
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Stefan
  full_name: Blügel, Stefan
  last_name: Blügel
citation:
  ama: Friedrich C, Schindlmayr A, Blügel S. Efficient calculation of the Coulomb
    matrix and its expansion around k=0 within the FLAPW method. <i>Computer Physics
    Communications</i>. 2009;180(3):347-359. doi:<a href="https://doi.org/10.1016/j.cpc.2008.10.009">10.1016/j.cpc.2008.10.009</a>
  apa: Friedrich, C., Schindlmayr, A., &#38; Blügel, S. (2009). Efficient calculation
    of the Coulomb matrix and its expansion around k=0 within the FLAPW method. <i>Computer
    Physics Communications</i>, <i>180</i>(3), 347–359. <a href="https://doi.org/10.1016/j.cpc.2008.10.009">https://doi.org/10.1016/j.cpc.2008.10.009</a>
  bibtex: '@article{Friedrich_Schindlmayr_Blügel_2009, title={Efficient calculation
    of the Coulomb matrix and its expansion around k=0 within the FLAPW method}, volume={180},
    DOI={<a href="https://doi.org/10.1016/j.cpc.2008.10.009">10.1016/j.cpc.2008.10.009</a>},
    number={3}, journal={Computer Physics Communications}, publisher={Elsevier}, author={Friedrich,
    Christoph and Schindlmayr, Arno and Blügel, Stefan}, year={2009}, pages={347–359}
    }'
  chicago: 'Friedrich, Christoph, Arno Schindlmayr, and Stefan Blügel. “Efficient
    Calculation of the Coulomb Matrix and Its Expansion around K=0 within the FLAPW
    Method.” <i>Computer Physics Communications</i> 180, no. 3 (2009): 347–59. <a
    href="https://doi.org/10.1016/j.cpc.2008.10.009">https://doi.org/10.1016/j.cpc.2008.10.009</a>.'
  ieee: 'C. Friedrich, A. Schindlmayr, and S. Blügel, “Efficient calculation of the
    Coulomb matrix and its expansion around k=0 within the FLAPW method,” <i>Computer
    Physics Communications</i>, vol. 180, no. 3, pp. 347–359, 2009, doi: <a href="https://doi.org/10.1016/j.cpc.2008.10.009">10.1016/j.cpc.2008.10.009</a>.'
  mla: Friedrich, Christoph, et al. “Efficient Calculation of the Coulomb Matrix and
    Its Expansion around K=0 within the FLAPW Method.” <i>Computer Physics Communications</i>,
    vol. 180, no. 3, Elsevier, 2009, pp. 347–59, doi:<a href="https://doi.org/10.1016/j.cpc.2008.10.009">10.1016/j.cpc.2008.10.009</a>.
  short: C. Friedrich, A. Schindlmayr, S. Blügel, Computer Physics Communications
    180 (2009) 347–359.
date_created: 2020-08-28T22:50:49Z
date_updated: 2025-12-16T11:10:22Z
ddc:
- '530'
department:
- _id: '296'
- _id: '35'
- _id: '15'
- _id: '170'
- _id: '230'
doi: 10.1016/j.cpc.2008.10.009
external_id:
  arxiv:
  - '0811.2363'
  isi:
  - '000264735800002'
file:
- access_level: closed
  content_type: application/pdf
  creator: schindlm
  date_created: 2020-10-05T10:35:14Z
  date_updated: 2020-10-05T10:41:07Z
  description: © 2008 Elsevier B.V.
  file_id: '19875'
  file_name: 1-s2.0-S0010465508003664-main.pdf
  file_size: 311274
  relation: main_file
  title: Efficient calculation of the Coulomb matrix and its expansion around k=0
    within the FLAPW method
file_date_updated: 2020-10-05T10:41:07Z
has_accepted_license: '1'
intvolume: '       180'
isi: '1'
issue: '3'
language:
- iso: eng
page: 347-359
publication: Computer Physics Communications
publication_identifier:
  issn:
  - 0010-4655
publication_status: published
publisher: Elsevier
quality_controlled: '1'
status: public
title: Efficient calculation of the Coulomb matrix and its expansion around k=0 within
  the FLAPW method
type: journal_article
user_id: '16199'
volume: 180
year: '2009'
...
---
_id: '18595'
abstract:
- lang: eng
  text: Excited-state calculations, notably for quasiparticle band structures, are
    nowadays routinely performed within the GW approximation for the electronic self-energy.
    Nevertheless, certain numerical approximations and simplifications are still employed
    in practice to make the computations feasible. An important aspect for periodic
    systems is the proper treatment of the singularity of the screened Coulomb interaction
    in reciprocal space, which results from the slow 1/r decay in real space. This
    must be done without introducing artificial interactions between the quasiparticles
    and their periodic images in repeated cells, which occur when integrals of the
    screened Coulomb interaction are discretised in reciprocal space. An adequate
    treatment of both aspects is crucial for a numerically stable computation of the
    self-energy. In this article we build on existing schemes for isotropic screening
    and present an extension for anisotropic systems. We also show how the contributions
    to the dielectric function arising from the non-local part of the pseudopotentials
    can be computed efficiently. These improvements are crucial for obtaining a fast
    convergence with respect to the number of points used for the Brillouin zone integration
    and prove to be essential to make GW calculations for strongly anisotropic systems,
    such as slabs or multilayers, efficient.
article_type: original
author:
- first_name: Christoph
  full_name: Freysoldt, Christoph
  last_name: Freysoldt
- first_name: Philipp
  full_name: Eggert, Philipp
  last_name: Eggert
- first_name: Patrick
  full_name: Rinke, Patrick
  last_name: Rinke
- first_name: Arno
  full_name: Schindlmayr, Arno
  id: '458'
  last_name: Schindlmayr
  orcid: 0000-0002-4855-071X
- first_name: Rex W.
  full_name: Godby, Rex W.
  last_name: Godby
- first_name: Matthias
  full_name: Scheffler, Matthias
  last_name: Scheffler
citation:
  ama: Freysoldt C, Eggert P, Rinke P, Schindlmayr A, Godby RW, Scheffler M. Dielectric
    anisotropy in the GW space–time method. <i>Computer Physics Communications</i>.
    2007;176(1):1-13. doi:<a href="https://doi.org/10.1016/j.cpc.2006.07.018">10.1016/j.cpc.2006.07.018</a>
  apa: Freysoldt, C., Eggert, P., Rinke, P., Schindlmayr, A., Godby, R. W., &#38;
    Scheffler, M. (2007). Dielectric anisotropy in the GW space–time method. <i>Computer
    Physics Communications</i>, <i>176</i>(1), 1–13. <a href="https://doi.org/10.1016/j.cpc.2006.07.018">https://doi.org/10.1016/j.cpc.2006.07.018</a>
  bibtex: '@article{Freysoldt_Eggert_Rinke_Schindlmayr_Godby_Scheffler_2007, title={Dielectric
    anisotropy in the GW space–time method}, volume={176}, DOI={<a href="https://doi.org/10.1016/j.cpc.2006.07.018">10.1016/j.cpc.2006.07.018</a>},
    number={1}, journal={Computer Physics Communications}, publisher={Elsevier}, author={Freysoldt,
    Christoph and Eggert, Philipp and Rinke, Patrick and Schindlmayr, Arno and Godby,
    Rex W. and Scheffler, Matthias}, year={2007}, pages={1–13} }'
  chicago: 'Freysoldt, Christoph, Philipp Eggert, Patrick Rinke, Arno Schindlmayr,
    Rex W. Godby, and Matthias Scheffler. “Dielectric Anisotropy in the GW Space–Time
    Method.” <i>Computer Physics Communications</i> 176, no. 1 (2007): 1–13. <a href="https://doi.org/10.1016/j.cpc.2006.07.018">https://doi.org/10.1016/j.cpc.2006.07.018</a>.'
  ieee: 'C. Freysoldt, P. Eggert, P. Rinke, A. Schindlmayr, R. W. Godby, and M. Scheffler,
    “Dielectric anisotropy in the GW space–time method,” <i>Computer Physics Communications</i>,
    vol. 176, no. 1, pp. 1–13, 2007, doi: <a href="https://doi.org/10.1016/j.cpc.2006.07.018">10.1016/j.cpc.2006.07.018</a>.'
  mla: Freysoldt, Christoph, et al. “Dielectric Anisotropy in the GW Space–Time Method.”
    <i>Computer Physics Communications</i>, vol. 176, no. 1, Elsevier, 2007, pp. 1–13,
    doi:<a href="https://doi.org/10.1016/j.cpc.2006.07.018">10.1016/j.cpc.2006.07.018</a>.
  short: C. Freysoldt, P. Eggert, P. Rinke, A. Schindlmayr, R.W. Godby, M. Scheffler,
    Computer Physics Communications 176 (2007) 1–13.
date_created: 2020-08-28T16:52:21Z
date_updated: 2022-11-11T06:50:39Z
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