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The Journal of Chemical Physics
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August 17, 2018
Coupled-cluster based basis sets for valence correlation calculations. New primitives, frozen atomic natural orbitals, and basis sets from double to hextuple zeta for atoms H, He, and B-Ne
Daniel Claudino, Rodney J Bartlett
Journal of Chemical Theory and Computation
|
January 9, 2019
Automatic Partition of Orbital Spaces Based on Singular Value Decomposition in the Context of Embedding Theories
Daniel Claudino, Nicholas J Mayhall
The Journal of Physical Chemistry. A
|
February 10, 2026
Analysis of Fourth-, Fifth-, and Infinite-Order Triple Excitations in Unitary Coupled Cluster Theory
Zachary W Windom, Daniel Claudino
Journal of Chemical Theory and Computation
|
September 24, 2019
Simple and Efficient Truncation of Virtual Spaces in Embedded Wave Functions via Concentric Localization
Daniel Claudino, Nicholas J Mayhall
The Journal of Chemical Physics
|
March 17, 2016
Coupled-cluster based basis sets for valence correlation calculations
Daniel Claudino, Ricardo Gargano, Rodney J Bartlett
The Journal of Chemical Physics
|
July 11, 2016
Erratum: "Coupled-cluster based basis sets for valence correlation calculations" [J. Chem. Phys. 144, 104106 (2016)]
Daniel Claudino, Ricardo Gargano, Rodney J Bartlett
The Journal of Physical Chemistry. A
|
August 8, 2024
An Attractive Way to Correct for Missing Singles Excitations in Unitary Coupled Cluster Doubles Theory
Zachary W Windom, Daniel Claudino, Rodney J Bartlett
The Journal of Chemical Physics
|
June 4, 2024
A new "gold standard": Perturbative triples corrections in unitary coupled cluster theory and prospects for quantum computing
Zachary W Windom, Daniel Claudino, Rodney J Bartlett
The Journal of Physical Chemistry Letters
|
June 8, 2023
Modeling Singlet Fission on a Quantum Computer
Daniel Claudino, Bo Peng, Karol Kowalski, et al.
The Journal of Chemical Physics
|
January 2, 2026
Toward the "platinum standard" of quantum chemistry on quantum computers: Perturbative quadruple corrections in unitary coupled cluster theory
Zachary W Windom, Luke Bertels, Daniel Claudino, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 15) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
August 17, 2018
Coupled-cluster based basis sets for valence correlation calculations. New primitives, frozen atomic natural orbitals, and basis sets from double to hextuple zeta for atoms H, He, and B-Ne
Daniel Claudino, Rodney J Bartlett
Journal of Chemical Theory and Computation
|
January 9, 2019
Automatic Partition of Orbital Spaces Based on Singular Value Decomposition in the Context of Embedding Theories
Daniel Claudino, Nicholas J Mayhall
The Journal of Physical Chemistry. A
|
February 10, 2026
Analysis of Fourth-, Fifth-, and Infinite-Order Triple Excitations in Unitary Coupled Cluster Theory
Zachary W Windom, Daniel Claudino
Journal of Chemical Theory and Computation
|
September 24, 2019
Simple and Efficient Truncation of Virtual Spaces in Embedded Wave Functions via Concentric Localization
Daniel Claudino, Nicholas J Mayhall
The Journal of Chemical Physics
|
March 17, 2016
Coupled-cluster based basis sets for valence correlation calculations
Daniel Claudino, Ricardo Gargano, Rodney J Bartlett
The Journal of Chemical Physics
|
July 11, 2016
Erratum: "Coupled-cluster based basis sets for valence correlation calculations" [J. Chem. Phys. 144, 104106 (2016)]
Daniel Claudino, Ricardo Gargano, Rodney J Bartlett
The Journal of Physical Chemistry. A
|
August 8, 2024
An Attractive Way to Correct for Missing Singles Excitations in Unitary Coupled Cluster Doubles Theory
Zachary W Windom, Daniel Claudino, Rodney J Bartlett
The Journal of Chemical Physics
|
June 4, 2024
A new "gold standard": Perturbative triples corrections in unitary coupled cluster theory and prospects for quantum computing
Zachary W Windom, Daniel Claudino, Rodney J Bartlett
The Journal of Physical Chemistry Letters
|
June 8, 2023
Modeling Singlet Fission on a Quantum Computer
Daniel Claudino, Bo Peng, Karol Kowalski, et al.
The Journal of Chemical Physics
|
January 2, 2026
Toward the "platinum standard" of quantum chemistry on quantum computers: Perturbative quadruple corrections in unitary coupled cluster theory
Zachary W Windom, Luke Bertels, Daniel Claudino, et al.
Page
of 2