Ksenia Bravaya
Affiliations: | 2008 | Lomonosov Moscow State University | |
| 2009-2013 | University of Southern California, Los Angeles, CA, United States | ||
| 2013- | Boston University, Boston, MA, United States |
Area:
theoretical chemistryGoogle:
"Ksenia Bravaya"Mean distance: (not calculated yet)
Parents
Sign in to add mentor| Alexander V. Nemukhin | grad student | Moscow State | |
| Anna I. Krylov | post-doc | 2009-2013 | USC |
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Publications
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| Gayvert JR, Bravaya KB. (2022) Application of Box and Voronoi CAPs for Metastable Electronic States in Molecular Clusters. The Journal of Physical Chemistry. A. 126: 5070-5078 |
| Gayvert JR, Bravaya KB. (2022) Projected CAP-EOM-CCSD method for electronic resonances. The Journal of Chemical Physics. 156: 094108 |
| Epifanovsky E, Gilbert ATB, Feng X, et al. (2021) Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package. The Journal of Chemical Physics. 155: 084801 |
| Kim Y, Bui Y, Tazhigulov RN, et al. (2020) Effective Fragment Potentials for Flexible Molecules: Transferability of Parameters and Amino Acid Database. Journal of Chemical Theory and Computation |
| RKTP, Kočišek J, Bravaya K, et al. (2020) Electron-induced vibrational excitation and dissociative electron attachment in methyl formate Physical Chemistry Chemical Physics. 22: 518-524 |
| Tazhigulov RN, Gurunathan PK, Kim Y, et al. (2019) Polarizable embedding for simulating redox potentials of biomolecules. Physical Chemistry Chemical Physics : Pccp |
| Li Z, Ryszka M, Dawley MM, et al. (2019) Dipole-Supported Electronic Resonances Mediate Electron-Induced Amide Bond Cleavage. Physical Review Letters. 122: 073002 |
| Lee MK, Bravaya KB, Coker DF. (2017) First Principles Models for Biological Light-harvesting: Phycobiliprotein Complexes from Cryptophyte Algae. Journal of the American Chemical Society |
| Jagau TC, Bravaya KB, Krylov AI. (2017) Extending Quantum Chemistry of Bound States to Electronic Resonances. Annual Review of Physical Chemistry. 68: 525-553 |
| Acharya A, Bogdanov AM, Grigorenko BL, et al. (2016) Photoinduced Chemistry in Fluorescent Proteins: Curse or Blessing? Chemical Reviews |