Meyer, M. T., &; Schindlmayr, A. (2024). Derivation of Miller’s rule for the nonlinear optical susceptibility of a quantum anharmonic oscillator. Journal of Physics B: Atomic, Molecular and Optical Physics, 57(9), Article 095001.https://doi.org/10.1088/1361-6455/ad369c 
LibreCat: /record/52723
DOI: 10.1088/1361-6455/ad369c
WoS: 001196678300001

Schmidt, F., Kozub, A. L., Gerstmann, U., Schmidt, W. G., &; Schindlmayr, A. (2022). Electron polarons in lithium niobate: Charge localization, lattice deformation, and optical response. In G. Corradi &; L. Kovács (Eds.), New Trends in Lithium Niobate: From Bulk to Nanocrystals (pp. 231–248). MDPI.https://doi.org/10.3390/books978-3-0365-3339-1 
LibreCat: /record/30288
DOI: 10.3390/books978-3-0365-3339-1

Neufeld, S., Schindlmayr, A., &; Schmidt, W. G. (2022). Quasiparticle energies and optical response of RbTiOPO4 and KTiOAsO4. Journal of Physics: Materials, 5(1), Article 015002.https://doi.org/10.1088/2515-7639/ac3384 
LibreCat: /record/26627
DOI: 10.1088/2515-7639/ac3384
WoS: 000721060500001

Schindlmayr, A. (2022). Programmierung und Computersimulationen. In J. Gerick, A. Sommer, &; G. Zimmermann (Eds.), Kompetent Prüfungen gestalten: 60 Prüfungsformate für die Hochschullehre (2nd ed., pp. 270–274). Waxmann.https://doi.org/10.36198/9783838558592 
LibreCat: /record/29808
DOI: 10.36198/9783838558592

Schmidt, F., Kozub, A. L., Gerstmann, U., Schmidt, W. G., &; Schindlmayr, A. (2022). A density-functional theory study of hole and defect-bound exciton polarons in lithium niobate. Crystals, 12(11), Article 1586.https://doi.org/10.3390/cryst12111586 
LibreCat: /record/44088
DOI: 10.3390/cryst12111586
WoS: 000895837200001

Schmidt, F., Kozub, A. L., Gerstmann, U., Schmidt, W. G., &; Schindlmayr, A. (2021). Electron polarons in lithium niobate: Charge localization, lattice deformation, and optical response. Crystals, 11, 542.https://doi.org/10.3390/cryst11050542 
LibreCat: /record/21946
DOI: 10.3390/cryst11050542
WoS: 000653822700001

Bidaraguppe Ramesh, N., Schmidt, F., &; Schindlmayr, A. (2021). Lattice parameters and electronic band gap of orthorhombic potassium sodium niobate K0.5N.5NbO3 from density-functional theory. The European Physical Journal B, 94(8), Article 169.https://doi.org/10.1140/epjb/s10051-021-00179-8 
LibreCat: /record/22960
DOI: 10.1140/epjb/s10051-021-00179-8
WoS: 000687163200002

Friedrich, C., Blügel, S., &; Schindlmayr, A. (2021). Erratum: Efficient implementation of the GW approximation within the all-electron FLAPW method [Phys. Rev. B 81, 125102 (2010)]. Physical Review B, 104(3), Article 039901.https://doi.org/10.1103/PhysRevB.104.039901 
LibreCat: /record/22761
DOI: 10.1103/PhysRevB.104.039901
WoS: 000671587300006

Kozub, A. L., Schindlmayr, A., Gerstmann, U., &; Schmidt, W. G. (2021). Polaronic enhancement of second-harmonic generation in lithium niobate. Physical Review B, 104, 174110.https://doi.org/10.1103/PhysRevB.104.174110 
LibreCat: /record/23418
DOI: 10.1103/PhysRevB.104.174110
WoS: 000720931400007
arXiv: 2106.01145

Schmidt, F., Kozub, A. L., Biktagirov, T., Eigner, C., Silberhorn, C., Schindlmayr, A., Schmidt, W. G., &; Gerstmann, U. (2020). Free and defect-bound (bi)polarons in LiNbO3: Atomic structure and spectroscopic signatures from ab initio calculations. Physical Review Research, 2(4), Article 043002.https://doi.org/10.1103/PhysRevResearch.2.043002 
LibreCat: /record/19190
DOI: 10.1103/PhysRevResearch.2.043002
WoS: 000604206300002

Schmidt, F., Riefer, A., Schmidt, W. G., Schindlmayr, A., Imlau, M., Dobener, F., Mengel, N., Chatterjee, S., &; Sanna, S. (2019). Quasiparticle and excitonic effects in the optical response of KNbO3. Physical Review Materials, 3(5), Article 054401.https://doi.org/10.1103/PhysRevMaterials.3.054401 
LibreCat: /record/10014
DOI: 10.1103/PhysRevMaterials.3.054401
WoS: 000467044000003

Neufeld, S., Bocchini, A., Gerstmann, U., Schindlmayr, A., &; Schmidt, W. G. (2019). Potassium titanyl phosphate (KTP) quasiparticle energies and optical response. Journal of Physics: Materials, 2, 045003.https://doi.org/10.1088/2515-7639/ab29ba 
LibreCat: /record/13365
DOI: 10.1088/2515-7639/ab29ba
WoS: 000560410300003

Schindlmayr, A. (2018). Exact formulation of the transverse dynamic spin susceptibility as an initial-value problem. Advances in Mathematical Physics, 2018.https://doi.org/10.1155/2018/3732892 
LibreCat: /record/18466
DOI: 10.1155/2018/3732892
WoS: 000422773000001

Friedrich, M., Schmidt, W. G., Schindlmayr, A., &; Sanna, S. (2018). Erratum: Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory [Phys. Rev. Materials 1, 034401 (2017)]. Physical Review Materials, 2(1).https://doi.org/10.1103/PhysRevMaterials.2.019902 
LibreCat: /record/13410
DOI: 10.1103/PhysRevMaterials.2.019902
WoS: 000419778500006

Riefer, A., Weber, N., Mund, J., Yakovlev, D. R., Bayer, M., Schindlmayr, A.,https://doi.org/10.1088/1361-648x/aa6b2a__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 
LibreCat: /record/7481
DOI: 10.1088/1361-648x/aa6b2a
WoS: 000400093100001
PMID: 28374685

Friedrich, M., Schmidt, W. G., Schindlmayr, A., &; Sanna, S. (2017). Polaron optical absorption in congruent lithium niobate from time-dependent density-functional theory. Physical Review Materials, 1(5).https://doi.org/10.1103/PhysRevMaterials.1.054406 
LibreCat: /record/13416
DOI: 10.1103/PhysRevMaterials.1.054406
WoS: 000416586100003

Friedrich, M., Schmidt, W. G., Schindlmayr, A., &; Sanna, S. (2017). Optical properties of titanium-doped lithium niobate from time-dependent density-functional theory. Physical Review Materials, 1(3).https://doi.org/10.1103/PhysRevMaterials.1.034401 
LibreCat: /record/10021
DOI: 10.1103/PhysRevMaterials.1.034401
WoS: 000416562300001

Schmidt, F., Landmann, M., Rauls, E., Argiolas, N., Sanna, S., Schmidt, W. G., &; Schindlmayr, A. (2017). Consistent atomic geometries and electronic structure of five phases of potassium niobate from density-functional theory. Advances in Materials Science and Engineering, 2017.https://doi.org/10.1155/2017/3981317 
LibreCat: /record/10023
DOI: 10.1155/2017/3981317
WoS: 000394873300001

Riefer, A., Friedrich, M., Sanna, S., Gerstmann, U., Schindlmayr, A., &; Schmidt, W. G. (2016). LiNbO3 electronic structure: Many-body interactions, spin-orbit coupling, and thermal effects. Physical Review B, 93(7).https://doi.org/10.1103/PhysRevB.93.075205 
LibreCat: /record/10024
DOI: 10.1103/PhysRevB.93.075205
WoS: 000370794800004

Friedrich, M., Schindlmayr, A., Schmidt, W. G., &; Sanna, S. (2016). LiTaO3 phonon dispersion and ferroelectric transition calculated from first principles. Physica Status Solidi B, 253(4), 683–689.https://doi.org/10.1002/pssb.201552576 
LibreCat: /record/10025
DOI: 10.1002/pssb.201552576
WoS: 000374142500015