Publications related to computational spectroscopies:

1. N. P. Gallop, D. R. Maslennikov, N. Mondal, K. P. Goetz, Z. Dai, A. M. Schankler, W. Sung, S. Nihonyanagi, T. Tahara, M. I. Bodnarchuk, M. V. Kovalenko, Y. Vaynzof, A. M. Rappe, A. A. Bakulin, Ultrafast vibrational control of organohalide perovskite optoelectronic devices using vibrationally promoted electronic resonance. Nature Materials 23, 88 (2024)
2. Z. Zhang, J. Zhang, Z.-J. Liu, N. S. Dahod, W. Paritmongkol, N. Brown, A. Stollmann, W. S. Lee, Y.-C. Chien, Z. Dai, K. A. Nelson, W. A. Tisdale, A. M. Rappe, E. Baldini, Discovery of enhanced lattice dynamics in a single-layered hybrid perovskite. Science Advances 9, eadg4417 (2023)
3. M. Menahem, Z. Dai, S. Aharon, R. Sharma, M. Asher, Y. Diskin-Posner, R. Korobko, A. M. Rappe, O. Yaffe, Strongly anharmonic octahedral tilting in two-dimensional hybrid halide perovskites. ACS nano 15, 10153 (2021)
4. R. Sharma*, Z. Dai*, L. Gao, T. M. Brenner, L. Yadgarov, J. Zhang, Y. Rakita, R. Korobko, A. M. Rappe, O. Yaffe, Elucidating the atomistic origin of anharmonicity in tetragonal CH3NH3PbI3 with Raman scattering. Physical Review Materials 4, 092401 (2020) (*Equal contribution)
5. R. Sharma, M. Menahem, Z. Dai, L. Gao, T. M. Brenner, L. Yadgarov, J. Zhang, Y. Rakita, R. Korobko, I. Pinkas, A. M. Rappe, O. Yaffe, Lattice mode symmetry analysis of the orthorhombic phase of methylammonium lead iodide using polarized Raman. Physical Review Materials 4, 051601 (2020)
6. A. Bernasconi, K. Page, Z. Dai, L. Z. Tan, A. M. Rappe, L. Malavasi, Ubiquitous Short-Range Distortion of Hybrid Perovskites and Hydrogen-Bonding Role: the MAPbCl3 Case. The Journal of Physical Chemistry C 122, 28265-28272 (2018)