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Journal of Chemical Theory and Computation
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April 25, 2023
Real-Time Equation-of-Motion Coupled-Cluster Cumulant Green's Function Method: Heterogeneous Parallel Implementation Based on the Tensor Algebra for Many-Body Methods Infrastructure
Himadri Pathak, Ajay Panyala, Bo Peng, et al.
The Journal of Chemical Physics
|
August 3, 2022
Real-time equation-of-motion CC cumulant and CC Green's function simulations of photoemission spectra of water and water dimer
Fernando D Vila, John J Rehr, Himadri Pathak, et al.
The Journal of Chemical Physics
|
July 10, 2023
TAMM: Tensor algebra for many-body methods
Erdal Mutlu, Ajay Panyala, Nitin Gawande, et al.
Journal of Chemical Theory and Computation
|
September 28, 2023
A Perspective on Sustainable Computational Chemistry Software Development and Integration
Rosa Di Felice, Maricris L Mayes, Ryan M Richard, et al.
Chemical Reviews
|
March 31, 2021
From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape
Karol Kowalski, Raymond Bair, Nicholas P Bauman, et al.
The Journal of Chemical Physics
|
October 21, 2024
Electronic structure simulations in the cloud computing environment
Eric J Bylaska, Ajay Panyala, Nicholas P Bauman, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 6) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
April 25, 2023
Real-Time Equation-of-Motion Coupled-Cluster Cumulant Green's Function Method: Heterogeneous Parallel Implementation Based on the Tensor Algebra for Many-Body Methods Infrastructure
Himadri Pathak, Ajay Panyala, Bo Peng, et al.
The Journal of Chemical Physics
|
August 3, 2022
Real-time equation-of-motion CC cumulant and CC Green's function simulations of photoemission spectra of water and water dimer
Fernando D Vila, John J Rehr, Himadri Pathak, et al.
The Journal of Chemical Physics
|
July 10, 2023
TAMM: Tensor algebra for many-body methods
Erdal Mutlu, Ajay Panyala, Nitin Gawande, et al.
Journal of Chemical Theory and Computation
|
September 28, 2023
A Perspective on Sustainable Computational Chemistry Software Development and Integration
Rosa Di Felice, Maricris L Mayes, Ryan M Richard, et al.
Chemical Reviews
|
March 31, 2021
From NWChem to NWChemEx: Evolving with the Computational Chemistry Landscape
Karol Kowalski, Raymond Bair, Nicholas P Bauman, et al.
The Journal of Chemical Physics
|
October 21, 2024
Electronic structure simulations in the cloud computing environment
Eric J Bylaska, Ajay Panyala, Nicholas P Bauman, et al.
Page
of 1