@articleBadalov_Bocchini_Wilhelm_Kozub_Gerstmann_Schmidt, title=Rutile, anatase, brookite and titania thin film from Hubbard corrected and hybrid DFT, DOI=10.1088/2053-1591/ace0fa, journal=Materials Research Express, publisher=IOP Publishing, author=Badalov, Sabuhi and Bocchini, Adriana and Wilhelm, Rene and Kozub, A. L. and Gerstmann, Uwe and Schmidt, Wolf Gero 
LibreCat: /record/45764
DOI: 10.1088/2053-1591/ace0fa

@articlePadberg_Quiring_Bocchini_Santandrea_Gerstmann_Schmidt_Silberhorn_Eigner_2022, title=DC Ionic Conductivity in KTP and Its Isomorphs: Properties, Methods for Suppression, and Its Connection to Gray Tracking, volume=12, DOI=10.3390/cryst12101359, journal=Crystals, author=Padberg, Laura and Quiring, Viktor and Bocchini, Adriana and Santandrea, Matteo and Gerstmann, Uwe and Schmidt, Wolf Gero and Silberhorn, Christine and Eigner, Christof, year=2022, pages=1359 
LibreCat: /record/33484
DOI: 10.3390/cryst12101359

@articleBocchini_Gerstmann_Bartley_Steinrück_Henkel_Schmidt_2022, title=Electrochemical performance of KTiOAsO_4 (KTA) in potassium-ion batteries from density-functional theory, volume=6, DOI=10.1103/PhysRevMaterials.6.105401, journal=Phys. Rev. Materials, publisher=American Physical Society, author=Bocchini, Adriana and Gerstmann, Uwe and Bartley, Tim and Steinrück, Hans-Georg and Henkel, Gerald and Schmidt, Wolf Gero, year=2022, pages=105401 
LibreCat: /record/33965
DOI: 10.1103/PhysRevMaterials.6.105401

@articleBocchini_Gerstmann_Schmidt_2022, title=Oxygen vacancies in KTiOPO_4: Optical absorption from hybrid DFT, volume=105, DOI=10.1103/PhysRevB.105.205118, journal=Phys. Rev. B, publisher=American Physical Society, author=Bocchini, Adriana and Gerstmann, Uwe and Schmidt, Wolf Gero, year=2022, pages=205118 
LibreCat: /record/31254
DOI: 10.1103/PhysRevB.105.205118

@articleNeufeld_Bocchini_Schmidt_2021, title=Potassium titanyl phosphate Z- and Y-cut surfaces from density-functional theory, DOI=10.1103/physrevmaterials.5.064407, journal=Physical Review Materials, author=Neufeld, Sergej and Bocchini, Adriana and Schmidt, Wolf Gero, year=2021 
LibreCat: /record/22310
DOI: 10.1103/physrevmaterials.5.064407

@articleBocchini_Eigner_Silberhorn_Schmidt_Gerstmann_2020, title=Understanding gray track formation in KTP: Ti^3+ centers studied from first principles, volume=4, DOI=10.1103/PhysRevMaterials.4.124402, journal=Phys. Rev. Materials, publisher=American Physical Society, author=Bocchini, Adriana and Eigner, Christof and Silberhorn, Christine and Schmidt, Wolf Gero and Gerstmann, Uwe, year=2020, pages=124402 
LibreCat: /record/20682
DOI: 10.1103/PhysRevMaterials.4.124402

@articleNeufeld_Bocchini_Gerstmann_Schindlmayr_Schmidt_2019, title=Potassium titanyl phosphate (KTP) quasiparticle energies and optical response, volume=2, DOI=10.1088/2515-7639/ab29ba, journal=Journal of Physics: Materials, publisher=IOP Publishing, author=Neufeld, Sergej and Bocchini, Adriana and Gerstmann, Uwe and Schindlmayr, Arno and Schmidt, Wolf Gero, year=2019, pages=045003 
LibreCat: /record/13365
DOI: 10.1088/2515-7639/ab29ba
WoS: 000560410300003

@articleBocchini_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 
LibreCat: /record/13429
DOI: 10.1088/1361-648x/ab295c