Diptarka Hait
University of California, Berkeley
H-index: 25
North America-United States
Top articles of Diptarka Hait
Prediction of Photodynamics of 200 nm Excited Cyclobutanone with Linear Response Electronic Structure and Ab Initio Multiple Spawning
arXiv preprint arXiv:2402.10710
2024/2/16
Predicting the X-ray Absorption Spectrum of Ozone with Single Configuration State Functions
Journal of Chemical Theory and Computation
2024/1/4
Diptarka Hait
H-Index: 15
Understanding ion-transfer reactions in silver electrodissolution and electrodeposition from first-principles calculations and experiments
Chemical Science
2024
Yang Zhao
H-Index: 7
Diptarka Hait
H-Index: 15
Shannon Boettcher
H-Index: 44
Martin Head-Gordon
H-Index: 72
When is a bond broken? The polarizability perspective.
Angewandte Chemie International Edition
2023/11/13
Diptarka Hait
H-Index: 15
1b1 splitting in the X-ray emission spectrum of liquid water is dominated by ultrafast dissociation
2023/9/15
Say no to optimization: A nonorthogonal quantum eigensolver
PRX Quantum
2023/7/17
Femtosecond symmetry breaking and coherent relaxation of methane cations via x-ray spectroscopy
Science
2023/5/19
Probing CI Bond Fission in the UV Photochemistry of 2-Iodothiophene with Core-to-Valence Transient Absorption Spectroscopy
arXiv preprint arXiv:2303.13467
2023/3/23
Ultrafast X-ray Spectroscopy of Intersystem Crossing in Hexafluoroacetylacetone: Chromophore Photophysics and Spectral Changes in the Face of Electron-Withdrawing Groups
The Journal of Physical Chemistry A
2023/1/13
Computing x-ray absorption spectra from linear-response particles atop optimized holes
The Journal of chemical physics
2022/5/28
Revisiting the performance of time-dependent density functional theory for electronic excitations: Assessment of 43 popular and recently developed functionals from rungs one to …
Journal of chemical theory and computation
2022/5/9
Diptarka Hait
H-Index: 15
Martin Head-Gordon
H-Index: 72
Real-Time Evolution for Ultracompact Hamiltonian Eigenstates on Quantum Hardware
PRX Quantum
2022/5/3
Relativistic Orbital-Optimized Density Functional Theory for Accurate Core-Level Spectroscopy
The Journal of Physical Chemistry Letters
2022/4/12
A Density Functional Odyssey Beyond Ground State Energies
2022
Diptarka Hait
H-Index: 15
Jahn-Teller distortion and dissociation of CCl 4+ by transient X-ray spectroscopy simultaneously at the carbon K-and chlorine L-edge
Chemical Science
2022
Diptarka Hait
H-Index: 15
Valeriu Scutelnic
H-Index: 6
Martin Head-Gordon
H-Index: 72
Stephen R Leone
H-Index: 43
Too big, too small, or just right? A benchmark assessment of density functional theory for predicting the spatial extent of the electron density of small chemical systems
The Journal of chemical physics
2021/2/21
Diptarka Hait
H-Index: 15
Martin Head-Gordon
H-Index: 72
Electron–Nuclear Dynamics Accompanying Proton-Coupled Electron Transfer
Journal of the American Chemical Society
2021/2/18
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
2021/8/28
Joonho Lee
H-Index: 15
Yuezhi Mao
H-Index: 14
Narbe Mardirossian
H-Index: 19
Pavel Pokhilko
H-Index: 7
Diptarka Hait
H-Index: 15
Ka Un Lao
H-Index: 18
Jie Liu
H-Index: 2
Felix Plasser
H-Index: 32
Zhi-Qiang You
H-Index: 4
Ying Zhu
H-Index: 9
Nicole Bellonzi
H-Index: 5
Kevin Carter-Fenk
H-Index: 8
Romit Chakraborty
H-Index: 6
Saswata Dasgupta
H-Index: 2
Marc De Wergifosse
H-Index: 10
Jia Deng
H-Index: 41
Shervin Fatehi
H-Index: 9
Qinghui Ge
H-Index: 7
Gergely Gidofalvi
H-Index: 12
Matthew Goldey
H-Index: 14
Joe Gomes
H-Index: 17
Sahil Gulania
H-Index: 4
Andreas Hauser
H-Index: 8
Maxim Ivanov
H-Index: 1
Hanjie Jiang
H-Index: 6
Jaehoon Kim
H-Index: 1
Zsuzsanna Koczor-Benda
H-Index: 6
Tim Kowalczyk
H-Index: 15
Arie Landau
H-Index: 11
Daniel Lefrancois
H-Index: 8
Yi-Pei Li
H-Index: 11
Hung-Hsuan Lin
H-Index: 4
You-Sheng Lin
H-Index: 15
Matthias Loipersberger
H-Index: 7
Thomas Markovich
H-Index: 5
Stephen Mason
H-Index: 14
Jan-Michael Mewes
H-Index: 14
Pierpaolo Morgante
H-Index: 4
Zheng Pei
H-Index: 1
Stefan Prager
H-Index: 7
Adam Rettig
H-Index: 3
Maximilian Scheurer
H-Index: 7
Wojciech Skomorowski
H-Index: 15
Exploring spin symmetry-breaking effects for static field ionization of atoms: Is there an analog to the Coulson–Fischer point in bond dissociation?
The Journal of chemical physics
2021/7/7
Revealing the nature of electron correlation in transition metal complexes with symmetry breaking and chemical intuition
The Journal of chemical physics
2021/5/21
Co-Authors
