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Journal of Chemical Theory and Computation
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June 22, 2018
Linear-Response Density Cumulant Theory for Excited Electronic States
Andreas V Copan, Alexander Yu Sokolov
Journal of Chemical Theory and Computation
|
November 19, 2015
Benchmark Study of Density Cumulant Functional Theory: Thermochemistry and Kinetics
Andreas V Copan, Alexander Yu Sokolov, Henry F Schaefer
The Journal of Physical Chemistry. A
|
February 12, 2019
Simulating X-ray Absorption Spectra with Linear-Response Density Cumulant Theory
Ruojing Peng, Andreas V Copan, Alexander Yu Sokolov
The Journal of Chemical Physics
|
February 10, 2015
Peroxyacetyl radical: electronic excitation energies, fundamental vibrational frequencies, and symmetry breaking in the first excited state
Andreas V Copan, Avery E Wiens, Ewa M Nowara, et al.
Journal of Chemical Theory and Computation
|
November 20, 2015
Investigating the Effects of Basis Set on Metal-Metal and Metal-Ligand Bond Distances in Stable Transition Metal Carbonyls: Performance of Correlation Consistent Basis Sets with 35 Density Functionals
Beulah S Narendrapurapu, Nancy A Richardson, Andreas V Copan, et al.
The Journal of Physical Chemistry. A
|
April 29, 2024
Radical Stereochemistry: Accounting for Diastereomers in Kinetic Mechanism Development
Andreas V Copan, Kevin B Moore, Sarah N Elliott, et al.
The Journal of Chemical Physics
|
January 8, 2018
Reinterpreting the infrared spectrum of H + HCN: Methylene amidogen radical and its coproducts
Avery E Wiens, Andreas V Copan, Elliot C Rossomme, et al.
Journal of the American Chemical Society
|
February 22, 2021
Substitution Reactions in the Pyrolysis of Acetone Revealed through a Modeling, Experiment, Theory Paradigm
Daniel P Zaleski, Raghu Sivaramakrishnan, Hailey R Weller, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 8) with videos related to
Sort By:
Page
of 1
Journal of Chemical Theory and Computation
|
June 22, 2018
Linear-Response Density Cumulant Theory for Excited Electronic States
Andreas V Copan, Alexander Yu Sokolov
Journal of Chemical Theory and Computation
|
November 19, 2015
Benchmark Study of Density Cumulant Functional Theory: Thermochemistry and Kinetics
Andreas V Copan, Alexander Yu Sokolov, Henry F Schaefer
The Journal of Physical Chemistry. A
|
February 12, 2019
Simulating X-ray Absorption Spectra with Linear-Response Density Cumulant Theory
Ruojing Peng, Andreas V Copan, Alexander Yu Sokolov
The Journal of Chemical Physics
|
February 10, 2015
Peroxyacetyl radical: electronic excitation energies, fundamental vibrational frequencies, and symmetry breaking in the first excited state
Andreas V Copan, Avery E Wiens, Ewa M Nowara, et al.
Journal of Chemical Theory and Computation
|
November 20, 2015
Investigating the Effects of Basis Set on Metal-Metal and Metal-Ligand Bond Distances in Stable Transition Metal Carbonyls: Performance of Correlation Consistent Basis Sets with 35 Density Functionals
Beulah S Narendrapurapu, Nancy A Richardson, Andreas V Copan, et al.
The Journal of Physical Chemistry. A
|
April 29, 2024
Radical Stereochemistry: Accounting for Diastereomers in Kinetic Mechanism Development
Andreas V Copan, Kevin B Moore, Sarah N Elliott, et al.
The Journal of Chemical Physics
|
January 8, 2018
Reinterpreting the infrared spectrum of H + HCN: Methylene amidogen radical and its coproducts
Avery E Wiens, Andreas V Copan, Elliot C Rossomme, et al.
Journal of the American Chemical Society
|
February 22, 2021
Substitution Reactions in the Pyrolysis of Acetone Revealed through a Modeling, Experiment, Theory Paradigm
Daniel P Zaleski, Raghu Sivaramakrishnan, Hailey R Weller, et al.
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of 1