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The Journal of Chemical Physics
|
September 15, 2014
Communication: Coupled-cluster interpretation of the photoelectron spectrum of Au₃⁻
Nicholas P Bauman, Jared A Hansen, Masahiro Ehara, et al.
Journal of Chemical Theory and Computation
|
September 11, 2020
Resource-Efficient Chemistry on Quantum Computers with the Variational Quantum Eigensolver and the Double Unitary Coupled-Cluster Approach
Mekena Metcalf, Nicholas P Bauman, Karol Kowalski, et al.
Journal of Molecular Modeling
|
November 14, 2013
Evaluation of density functional methods on the geometric and energetic descriptions of species involved in Cu⁺-promoted catalysis
Carlos E P Bernardo, Nicholas P Bauman, Piotr Piecuch, et al.
Frontiers in Chemistry
|
April 5, 2021
Quantum Solvers for Plane-Wave Hamiltonians: Abridging Virtual Spaces Through the Optimization of Pairwise Correlations
Eric J Bylaska, Duo Song, Nicholas P Bauman, et al.
The Journal of Chemical Physics
|
December 23, 2020
Index of multi-determinantal and multi-reference character in coupled-cluster theory
Rodney J Bartlett, Young Choon Park, Nicholas P Bauman, et al.
Journal of Chemical Theory and Computation
|
December 15, 2025
Quantum Electrodynamics Coupled-Cluster at Scale: High-Performance Implementation for Complex Systems
Nicholas P Bauman, Himadri Pathak, Marcus D Liebenthal, et al.
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.
Journal of Chemical Theory and Computation
|
November 24, 2015
The Cobalt-Methyl Bond Dissociation in Methylcobalamin: New Benchmark Analysis Based on Density Functional Theory and Completely Renormalized Coupled-Cluster Calculations
Pawel M Kozlowski, Manoj Kumar, Piotr Piecuch, et al.
Journal of Chemical Theory and Computation
|
September 4, 2025
Qubit-Efficient Quantum Chemistry with the ADAPT Variational Quantum Eigensolver and Double Unitary Downfolding
Harjeet Singh, Luke W Bertels, Daniel Claudino, et al.
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Search research articles
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Showing results (11-20 of 26) with videos related to
Sort By:
Page
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The Journal of Chemical Physics
|
September 15, 2014
Communication: Coupled-cluster interpretation of the photoelectron spectrum of Au₃⁻
Nicholas P Bauman, Jared A Hansen, Masahiro Ehara, et al.
Journal of Chemical Theory and Computation
|
September 11, 2020
Resource-Efficient Chemistry on Quantum Computers with the Variational Quantum Eigensolver and the Double Unitary Coupled-Cluster Approach
Mekena Metcalf, Nicholas P Bauman, Karol Kowalski, et al.
Journal of Molecular Modeling
|
November 14, 2013
Evaluation of density functional methods on the geometric and energetic descriptions of species involved in Cu⁺-promoted catalysis
Carlos E P Bernardo, Nicholas P Bauman, Piotr Piecuch, et al.
Frontiers in Chemistry
|
April 5, 2021
Quantum Solvers for Plane-Wave Hamiltonians: Abridging Virtual Spaces Through the Optimization of Pairwise Correlations
Eric J Bylaska, Duo Song, Nicholas P Bauman, et al.
The Journal of Chemical Physics
|
December 23, 2020
Index of multi-determinantal and multi-reference character in coupled-cluster theory
Rodney J Bartlett, Young Choon Park, Nicholas P Bauman, et al.
Journal of Chemical Theory and Computation
|
December 15, 2025
Quantum Electrodynamics Coupled-Cluster at Scale: High-Performance Implementation for Complex Systems
Nicholas P Bauman, Himadri Pathak, Marcus D Liebenthal, et al.
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.
Journal of Chemical Theory and Computation
|
November 24, 2015
The Cobalt-Methyl Bond Dissociation in Methylcobalamin: New Benchmark Analysis Based on Density Functional Theory and Completely Renormalized Coupled-Cluster Calculations
Pawel M Kozlowski, Manoj Kumar, Piotr Piecuch, et al.
Journal of Chemical Theory and Computation
|
September 4, 2025
Qubit-Efficient Quantum Chemistry with the ADAPT Variational Quantum Eigensolver and Double Unitary Downfolding
Harjeet Singh, Luke W Bertels, Daniel Claudino, et al.
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