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The Journal of Chemical Physics
|
January 5, 2011
An adaptive coupled-cluster theory: @CC approach
Dmitry I Lyakh, Rodney J Bartlett
The Journal of Chemical Physics
|
January 11, 2005
Automated generation of coupled-cluster diagrams: implementation in the multireference state-specific coupled-cluster approach with the complete-active-space reference
Dmitry I Lyakh, Vladimir V Ivanov, Ludwik Adamowicz
The Journal of Chemical Physics
|
February 27, 2008
A generalization of the state-specific complete-active-space coupled-cluster method for calculating electronic excited states
Dmitry I Lyakh, Vladimir V Ivanov, Ludwik Adamowicz
The Journal of Chemical Physics
|
May 20, 2006
Excited states in the multireference state-specific coupled-cluster theory with the complete active space reference
Vladimir V Ivanov, Ludwik Adamowicz, Dmitry I Lyakh
Physical Chemistry Chemical Physics : PCCP
|
March 28, 2009
Multireference state-specific coupled-cluster methods. State-of-the-art and perspectives
Vladimir V Ivanov, Dmitry I Lyakh, Ludwik Adamowicz
The Journal of Chemical Physics
|
November 14, 2012
The equation-of-motion coupled cluster method for triple electron attached states
Monika Musiał, Marta Olszówka, Dmitry I Lyakh, et al.
The Journal of Chemical Physics
|
May 24, 2013
Potential energy curves via double electron-attachment calculations: dissociation of alkali metal dimers
Monika Musiał, Katarzyna Kowalska-Szojda, Dmitry I Lyakh, et al.
The Journal of Chemical Physics
|
July 17, 2015
Discontinuities-free complete-active-space state-specific multi-reference coupled cluster theory for describing bond stretching and dissociation
Irina A Zaporozhets, Vladimir V Ivanov, Dmitry I Lyakh, et al.
The Journal of Physical Chemistry. A
|
September 13, 2019
Multilayer Divide-Expand-Consolidate Coupled-Cluster Method: Demonstrative Calculations of the Adsorption Energy of Carbon Dioxide in the Mg-MOF-74 Metal-Organic Framework
Ashleigh L Barnes, Dmytro Bykov, Dmitry I Lyakh, et al.
Journal of Chemical Theory and Computation
|
August 9, 2021
Implementation of Relativistic Coupled Cluster Theory for Massively Parallel GPU-Accelerated Computing Architectures
Johann V Pototschnig, Anastasios Papadopoulos, Dmitry I Lyakh, et al.
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of 1
Search research articles
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Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
The Journal of Chemical Physics
|
January 5, 2011
An adaptive coupled-cluster theory: @CC approach
Dmitry I Lyakh, Rodney J Bartlett
The Journal of Chemical Physics
|
January 11, 2005
Automated generation of coupled-cluster diagrams: implementation in the multireference state-specific coupled-cluster approach with the complete-active-space reference
Dmitry I Lyakh, Vladimir V Ivanov, Ludwik Adamowicz
The Journal of Chemical Physics
|
February 27, 2008
A generalization of the state-specific complete-active-space coupled-cluster method for calculating electronic excited states
Dmitry I Lyakh, Vladimir V Ivanov, Ludwik Adamowicz
The Journal of Chemical Physics
|
May 20, 2006
Excited states in the multireference state-specific coupled-cluster theory with the complete active space reference
Vladimir V Ivanov, Ludwik Adamowicz, Dmitry I Lyakh
Physical Chemistry Chemical Physics : PCCP
|
March 28, 2009
Multireference state-specific coupled-cluster methods. State-of-the-art and perspectives
Vladimir V Ivanov, Dmitry I Lyakh, Ludwik Adamowicz
The Journal of Chemical Physics
|
November 14, 2012
The equation-of-motion coupled cluster method for triple electron attached states
Monika Musiał, Marta Olszówka, Dmitry I Lyakh, et al.
The Journal of Chemical Physics
|
May 24, 2013
Potential energy curves via double electron-attachment calculations: dissociation of alkali metal dimers
Monika Musiał, Katarzyna Kowalska-Szojda, Dmitry I Lyakh, et al.
The Journal of Chemical Physics
|
July 17, 2015
Discontinuities-free complete-active-space state-specific multi-reference coupled cluster theory for describing bond stretching and dissociation
Irina A Zaporozhets, Vladimir V Ivanov, Dmitry I Lyakh, et al.
The Journal of Physical Chemistry. A
|
September 13, 2019
Multilayer Divide-Expand-Consolidate Coupled-Cluster Method: Demonstrative Calculations of the Adsorption Energy of Carbon Dioxide in the Mg-MOF-74 Metal-Organic Framework
Ashleigh L Barnes, Dmytro Bykov, Dmitry I Lyakh, et al.
Journal of Chemical Theory and Computation
|
August 9, 2021
Implementation of Relativistic Coupled Cluster Theory for Massively Parallel GPU-Accelerated Computing Architectures
Johann V Pototschnig, Anastasios Papadopoulos, Dmitry I Lyakh, et al.
Page
of 1