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The last 5 uploaded publications
Role of Polar Phonons in the Photo Excited State of Metal Halide Perovskites
Menno Bokdam, Tobias Sander, Alessandro Stroppa, Silvia Picozzi, D. D. Sarma, Cesare Franchini, Kresse Georg (2016). Role of Polar Phonons in the Photo Excited State of Metal Halide Perovskites. Scientific Reports, 6(1), DOI: 10.1038/srep28618.
Article187 days agoBehavior of Methylammonium Dipoles in MAPbX<sub>3</sub> (X = Br and I)
Sharada Govinda, Bhushan P. Kore, Menno Bokdam, Pratibha Mahale, Abhinav Kumar, Somnath Pal, Biswajit Bhattacharyya, Jonathan Lahnsteiner, Kresse Georg, Cesare Franchini, Anshu Pandey, D. D. Sarma (2017). Behavior of Methylammonium Dipoles in MAPbX<sub>3</sub> (X = Br and I). The Journal of Physical Chemistry Letters, 8(17), pp. 4113-4121, DOI: 10.1021/acs.jpclett.7b01740.
Article180 days agoRoom-temperature dynamic correlation between methylammonium molecules in lead-iodine based perovskites: An <i>ab initio</i> molecular dynamics perspective
Jonathan Lahnsteiner, Kresse Georg, Abhinav Kumar, D. D. Sarma, Cesare Franchini, Menno Bokdam (2016). Room-temperature dynamic correlation between methylammonium molecules in lead-iodine based perovskites: An <i>ab initio</i> molecular dynamics perspective. Physical review. B./Physical review. B, 94(21), DOI: 10.1103/physrevb.94.214114.
Article180 days agoAnisotropic magnetic couplings and structure-driven canted to collinear transitions in<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mi>Sr</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>IrO</mml:mi><mml:mn>4</mml:mn></mml:msub></mml:mrow></mml:math>by magnetically constrained noncollinear DFT
Peitao Liu, Sergii Khmelevskyi, Bongjae Kim, Martijn Marsman, Dianzhong Li, Xing‐Qiu Chen, D. D. Sarma, Kresse Georg, Cesare Franchini (2015). Anisotropic magnetic couplings and structure-driven canted to collinear transitions in<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:msub><mml:mi>Sr</mml:mi><mml:mn>2</mml:mn></mml:msub><mml:msub><mml:mi>IrO</mml:mi><mml:mn>4</mml:mn></mml:msub></mml:mrow></mml:math>by magnetically constrained noncollinear DFT. Physical Review B, 92(5), DOI: 10.1103/physrevb.92.054428.
Article180 days agoRelativistic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:mrow></mml:math> +BSE study of the optical properties of Ruddlesden-Popper iridates
Peitao Liu, Bongjae Kim, Xing‐Qiu Chen, D. D. Sarma, Kresse Georg, Cesare Franchini (2018). Relativistic <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:mrow><mml:mi>G</mml:mi><mml:mi>W</mml:mi></mml:mrow></mml:math> +BSE study of the optical properties of Ruddlesden-Popper iridates. Physical Review Materials, 2(7), DOI: 10.1103/physrevmaterials.2.075003.
Article174 days ago