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Anirban Hazra
Anirban Hazra
Verified email at iiserpune.ac.in
Title
Cited by
Cited by
Year
Derivation and efficient implementation of a recursion formula to calculate harmonic Franck–Condon factors for polyatomic molecules
A Hazra, M Nooijen
International journal of quantum chemistry 95 (4‐5), 643-657, 2003
1132003
First principles simulation of the UV absorption spectrum of ethylene using the vertical Franck-Condon approach
A Hazra, HH Chang, M Nooijen
The Journal of chemical physics 121 (5), 2125-2136, 2004
1122004
Transition-metal-free C–H hydroxylation of carbonyl compounds
MB Chaudhari, Y Sutar, S Malpathak, A Hazra, B Gnanaprakasam
Organic letters 19 (13), 3628-3631, 2017
822017
Role of solvent dynamics in ultrafast photoinduced proton-coupled electron transfer reactions in solution
A Hazra, AV Soudackov, S Hammes-Schiffer
The Journal of Physical Chemistry B 114 (38), 12319-12332, 2010
772010
Comparison of various Franck–Condon and vibronic coupling approaches for simulating electronic spectra: The case of the lowest photoelectron band of ethylene
A Hazra, M Nooijen
Physical Chemistry Chemical Physics 7 (8), 1759-1771, 2005
612005
Cumulant approach to the direct calculation of reduced density matrices: A critical analysis
M Nooijen, M Wladyslawski, A Hazra
The Journal of chemical physics 118 (11), 4832-4848, 2003
492003
Vibronic coupling in the excited cationic states of ethylene: Simulation of the photoelectron spectrum between 12 and 18eV
A Hazra, M Nooijen
The Journal of chemical physics 122 (20), 2005
462005
Isotope effects on the nonequilibrium dynamics of ultrafast photoinduced proton-coupled electron transfer reactions in solution
A Hazra, AV Soudackov, S Hammes-Schiffer
The Journal of Physical Chemistry Letters 2 (1), 36-40, 2011
442011
Benzosultines as Sulfur Dioxide (SO2) Donors
SR Malwal, M Gudem, A Hazra, H Chakrapani
Organic letters 15 (5), 1116-1119, 2013
412013
Multidimensional treatment of stochastic solvent dynamics in photoinduced proton-coupled electron transfer processes: Sequential, concerted, and complex branching mechanisms
AV Soudackov, A Hazra, S Hammes-Schiffer
The Journal of chemical physics 135 (14), 2011
382011
Combining the nuclear-electronic orbital approach with vibronic coupling theory: Calculation of the tunneling splitting for malonaldehyde
A Hazra, JH Skone, S Hammes-Schiffer
The Journal of chemical physics 130 (5), 2009
362009
Peptide bond planarity constrains hydrogen bond geometry and influences secondary structure conformations
KP Tan, K Singh, A Hazra, MS Madhusudhan
Current Research in Structural Biology 3, 1-8, 2021
232021
Estimating Franck-Condon factors using an NMR quantum processor
S Joshi, A Shukla, H Katiyar, A Hazra, TS Mahesh
Physical Review A 90 (2), 022303, 2014
182014
Weak interaction between HCHY (Y= O, S) and LiCl: a theoretical study
AB Hazra, S Pal
Journal of Molecular Structure: THEOCHEM 497 (1-3), 157-163, 2000
182000
π-Stacked Dimers of Fluorophenylacetylenes: Role of Dipole Moment
SI Mondal, S Sen, A Hazra, GN Patwari
The Journal of Physical Chemistry A 121 (18), 3383-3391, 2017
162017
Pathways for Excited-State Nonradiative Decay of 5, 6-Dihydroxyindole, a Building Block of Eumelanin
A Datar, A Hazra
The Journal of Physical Chemistry A 121 (14), 2790-2797, 2017
162017
C (sp3)–H Peroxidation of 3-Substituted Indolin-2-ones under Metal-Free Conditions
WW Ying, WM Zhu, Z Gao, H Liang, WT Wei
Synlett 29 (05), 663-667, 2018
142018
Mechanism of the chemiluminescent reaction between nitric oxide and ozone
M Gudem, A Hazra
The Journal of Physical Chemistry A 123 (4), 715-722, 2018
132018
Intramolecular cascade rearrangements of enynamine derived ketenimines: access to acyclic and cyclic amidines
DP Chauhan, SJ Varma, M Gudem, N Panigrahi, K Singh, A Hazra, ...
Organic & biomolecular chemistry 15 (22), 4822-4830, 2017
132017
Interplay between conjugation and size-driven delocalization leads to characteristic properties of substituted thymines
MA Manae, A Hazra
The Journal of Physical Chemistry A 121 (42), 8147-8153, 2017
122017
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