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Ashutosh Kumar
Ashutosh Kumar
Quantum Algorithm Developer at Photonic Inc.
Verified email at photonic.com - Homepage
Title
Cited by
Cited by
Year
PSI4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
RM Parrish, LA Burns, DGA Smith, AC Simmonett, AE DePrince III, ...
Journal of chemical theory and computation 13 (7), 3185-3197, 2017
11602017
PSI4 1.4: Open-source software for high-throughput quantum chemistry
DGA Smith, LA Burns, AC Simmonett, RM Parrish, MC Schieber, ...
The Journal of chemical physics 152 (18), 2020
5802020
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development
DGA Smith, LA Burns, DA Sirianni, DR Nascimento, A Kumar, AM James, ...
Journal of chemical theory and computation 14 (7), 3504-3511, 2018
1392018
Evaluating the evidence for exponential quantum advantage in ground-state quantum chemistry
S Lee, J Lee, H Zhai, Y Tong, AM Dalzell, A Kumar, P Helms, J Gray, ...
Nature communications 14 (1), 1952, 2023
1162023
Quantum simulation of electronic structure with a transcorrelated Hamiltonian: improved accuracy with a smaller footprint on the quantum computer
M Motta, TP Gujarati, JE Rice, A Kumar, C Masteran, JA Latone, E Lee, ...
Physical Chemistry Chemical Physics 22 (42), 24270-24281, 2020
57*2020
Frozen virtual natural orbitals for coupled-cluster linear-response theory
A Kumar, TD Crawford
The Journal of Physical Chemistry A 121 (3), 708-716, 2017
472017
Reduced‐scaling coupled cluster response theory: Challenges and opportunities
TD Crawford, A Kumar, AP BazantÚ, R Di Remigio
WIREs Comput Mol Sci 2019;e1406, 1-25, 2019
332019
Quantum simulation of molecular electronic states with a transcorrelated Hamiltonian: Higher accuracy with fewer qubits
A Kumar, A Asthana, C Masteran, EF Valeev, Y Zhang, L Cincio, S Tretiak, ...
Journal of Chemical Theory and Computation 18 (9), 5312-5324, 2022
29*2022
Massively Parallel Quantum Chemistry: A high-performance research platform for electronic structure
C Peng, CA Lewis, X Wang, MC Clement, K Pierce, V Rishi, F Pavošević, ...
The Journal of Chemical Physics 153 (4), 2020
292020
Explicitly correlated coupled cluster method for accurate treatment of open-shell molecules with hundreds of atoms
A Kumar, F Neese, EF Valeev
The Journal of chemical physics 153 (9), 2020
272020
Computing molecular excited states on a D-Wave quantum annealer
A Teplukhin, BK Kendrick, SM Mniszewski, Y Zhang, A Kumar, CFA Negre, ...
Scientific reports 11 (1), 18796, 2021
262021
Many-body quantum chemistry on massively parallel computers
JA Calvin, C Peng, V Rishi, A Kumar, EF Valeev
Chemical Reviews 121 (3), 1203-1231, 2020
242020
Quantum self-consistent equation-of-motion method for computing molecular excitation energies, ionization potentials, and electron affinities on a quantum computer
A Asthana, A Kumar, V Abraham, H Grimsley, Y Zhang, L Cincio, S Tretiak, ...
Chemical Science 14 (9), 2405-2418, 2023
212023
Incremental evaluation of coupled cluster dipole polarizabilities
J Friedrich, HR McAlexander, A Kumar, TD Crawford
Phys. Chem. Chem. Phys. 17, 14284-14296, 2014
192014
Frozen-density embedding potentials and chiroptical properties
TD Crawford, A Kumar, KP Hannon, S Höfener, L Visscher
Journal of Chemical Theory and Computation 11 (11), 5305-5315, 2015
172015
Quantum Simulation of Molecular Response Properties in the NISQ Era
A Kumar, A Asthana, V Abraham, TD Crawford, NJ Mayhall, Y Zhang, ...
Journal of Chemical Theory and Computation 19 (24), 9136-9150, 2023
3*2023
Comment on “Canonical transcorrelated theory with projected Slater-type geminals” [J. Chem. Phys. 136, 084107 (2012)]
C Masteran, A Kumar, N Teke, B Gaudel, T Yanai, EF Valeev
The Journal of Chemical Physics 158 (5), 057101, 2023
12023
Near-linear scaling explicitly correlated coupled cluster singles and doubles method based on an open-shell domain-based local pair natural orbitals
A Kumar, F Neese, E Valeev
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 258, 2019
12019
Accurate quantum chemistry calculations using NISQ era quantum computers
A Kumar, A Asthana, V Abraham, T Crawford, N Mayhall, Y Zhang, ...
APS March Meeting Abstracts 2023, F64. 006, 2023
2023
Quantum simulation of excited states with the transcorrrelated Hamiltonian: higher accuracy with fewer qubits
A Kumar, Y Zhang, P Dub, S Tretiak
APS March Meeting Abstracts 2022, N35. 002, 2022
2022
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