Ministry of Education
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Dr Amber Jain

vidwan id: 155727
Male

Assistant Professor, Department of Chemistry
Indian Institute of Technology Bombay

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Expertise

  • Applied Chemistry

Publications

Total Articles 27
Books 0
Proceedings 0

Publications

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Scopus

Citations 870
h-index 14

CrossRef

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Citations 355
h-index 8
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Bio

developing and applying theoretical methods to simulate chemical dynamics. The dynamical interplay of entangled protons and electrons lies particularly close to my heart.

Personal Details

  • Male
  • Assistant Professor , Indian Institute of Technology Bombay
  • Indian Institute of Technology Bombay, Powai
Ph.D
Other Institute 2014
Assistant Professor Mar 2018 – Present
Indian Institute of Technology Bombay | Department of Chemistry

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Scholarly Work

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Scholarly Publications

Libra: A modular software library for quantum nonadiabatic dynamics[Formula presented]

Open Access
Article
Software Impacts. Year: 2022. Volume: 14 .
Authors: Shakiba M.;Smith B.;Li W.;Dutra M.;Jain A.;Sun X.;Garashchuk S.;Akimov A.
DOI 10.1016/j.simpa.2022.100445
21

Coherence and Efficient Energy Transfer in Molecular Wires: Insights from Surface Hopping Simulations

Open Access
Article
Year: 2022. Volume: 23 , Issue: 24 .
Authors: Sindhu A.;Jain A.
DOI 10.1002/cphc.202200392
9

Detailed Balance and Independent Electron Surface-Hopping Method: The Importance of Decoherence and Correct Calculation of Diabatic Populations

Open Access
Article
Journal of Chemical Theory and Computation. Year: 2022. Volume: 18 , Issue: 8 , Pages: 4615-4626 .
Authors: Pradhan C.S.;Jain A.
DOI 10.1021/acs.jctc.2c00320
8

Benchmarking the Surface Hopping Method to Include Nuclear Quantum Effects

Open Access
Article
Journal of Chemical Theory and Computation. Year: 2021. Volume: 17 , Issue: 2 , Pages: 655-665 .
Authors: Sindhu A.;Jain A.
DOI 10.1021/acs.jctc.0c01065
16

Hierarchical equations of motion in the Libra software package

Open Access
Article
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. Year: 2020. Volume: 120 , Issue: 22 .
Authors: Temen S.;Jain A.;Akimov A.V.
DOI 10.1002/qua.26373
8

Simple and efficient theoretical approach to compute 2d optical spectra

Open Access
Article
Year: 2019. Volume: 123 , Issue: 7 , Pages: 1602-1617 .
Authors: Jain A.;Petit A.S.;Anna J.M.;Subotnik J.E.
DOI 10.1021/acs.jpcb.8b08674
5 14

Vibrational Energy Relaxation: A Benchmark for Mixed Quantum-Classical Methods

Open Access
Article
Year: 2018. Volume: 122 , Issue: 1 , Pages: 16-27 .
Authors: Jain A.;Subotnik J.
DOI 10.1021/acs.jpca.7b09018
16 29

Ultrafast Electronic Relaxation through a Conical Intersection: Nonadiabatic Dynamics Disentangled through an Oscillator Strength-Based Diabatization Framework

Open Access
Article
Year: 2017. Volume: 121 , Issue: 7 , Pages: 1425-1434 .
Authors: Medders G.R.;Alguire E.C.;Jain A.;Subotnik J.E.
DOI 10.1021/acs.jpca.6b12120
7 16