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The Journal of Physical Chemistry. A
|
September 18, 2014
Use of density functional theory orbitals in the GVVPT2 variant of second-order multistate multireference perturbation theory
Mark R Hoffmann, Trygve Helgaker
The Journal of Chemical Physics
|
July 12, 2012
Orbitally invariant internally contracted multireference unitary coupled cluster theory and its perturbative approximation: theory and test calculations of second order approximation
Zhenhua Chen, Mark R Hoffmann
The Journal of Chemical Physics
|
February 6, 2008
A momentum-conserving Franck-Condon approximation: theory and application to the photodissociation of Li2+ in an intense laser field
Patrick Nichols, Mark R Hoffmann
Journal of Chemical Theory and Computation
|
May 28, 2016
Correction to iCI: Iterative CI toward Full CI
Wenjian Liu, Mark R Hoffmann
Journal of Chemical Theory and Computation
|
January 15, 2016
iCI: Iterative CI toward full CI
Wenjian Liu, Mark R Hoffmann
The Journal of Physical Chemistry. A
|
September 27, 2021
Theoretical Calculations of the 242 nm Absorption of Propargyl Radical
Run R Li, Mark R Hoffmann
Frontiers in Chemistry
|
May 31, 2021
Low-Lying Electronic States of the Nickel Dimer
Patrick K Tamukong, Mark R Hoffmann
The Journal of Chemical Physics
|
August 7, 2010
Embedding theory for excited states
Yuriy G Khait, Mark R Hoffmann
The Journal of Chemical Physics
|
July 23, 2004
Multireference spin-adapted variant of density functional theory
Yuriy G Khait, Mark R Hoffmann
Molecules (Basel, Switzerland)
|
June 27, 2025
A Theoretical Investigation of the Selectivity of Aza-Crown Ether Structures Chelating Alkali Metal Cations for Potential Biosensing Applications
Mouhmad Elayyan, Mark R Hoffmann, Binglin Sui
Page
of 5
Search research articles
Search
Showing results (1-10 of 44) with videos related to
Sort By:
Page
of 5
The Journal of Physical Chemistry. A
|
September 18, 2014
Use of density functional theory orbitals in the GVVPT2 variant of second-order multistate multireference perturbation theory
Mark R Hoffmann, Trygve Helgaker
The Journal of Chemical Physics
|
July 12, 2012
Orbitally invariant internally contracted multireference unitary coupled cluster theory and its perturbative approximation: theory and test calculations of second order approximation
Zhenhua Chen, Mark R Hoffmann
The Journal of Chemical Physics
|
February 6, 2008
A momentum-conserving Franck-Condon approximation: theory and application to the photodissociation of Li2+ in an intense laser field
Patrick Nichols, Mark R Hoffmann
Journal of Chemical Theory and Computation
|
May 28, 2016
Correction to iCI: Iterative CI toward Full CI
Wenjian Liu, Mark R Hoffmann
Journal of Chemical Theory and Computation
|
January 15, 2016
iCI: Iterative CI toward full CI
Wenjian Liu, Mark R Hoffmann
The Journal of Physical Chemistry. A
|
September 27, 2021
Theoretical Calculations of the 242 nm Absorption of Propargyl Radical
Run R Li, Mark R Hoffmann
Frontiers in Chemistry
|
May 31, 2021
Low-Lying Electronic States of the Nickel Dimer
Patrick K Tamukong, Mark R Hoffmann
The Journal of Chemical Physics
|
August 7, 2010
Embedding theory for excited states
Yuriy G Khait, Mark R Hoffmann
The Journal of Chemical Physics
|
July 23, 2004
Multireference spin-adapted variant of density functional theory
Yuriy G Khait, Mark R Hoffmann
Molecules (Basel, Switzerland)
|
June 27, 2025
A Theoretical Investigation of the Selectivity of Aza-Crown Ether Structures Chelating Alkali Metal Cations for Potential Biosensing Applications
Mouhmad Elayyan, Mark R Hoffmann, Binglin Sui
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of 5