(Q52408557)

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The X1Sigmag+, B1Deltag, and B' 1Sigmag+ states of C2: a comparison of renormalized coupled-cluster and multireference methods with full configuration interaction benchmarks.

scientific article published in March 2005

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Europe PubMed Central

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:15836366%20AND%20SRC:MED&resulttype=core&format=json

10 January 2020

The X1Sigmag+, B1Deltag, and B' 1Sigmag+ states of C2: a comparison of renormalized coupled-cluster and multireference methods with full configuration interaction benchmarks (English)

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Europe PubMed Central

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https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:15836366%20AND%20SRC:MED&resulttype=core&format=json

10 January 2020

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10 January 2020

1

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10 January 2020

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C David Sherrill

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1 May 2018

http://europepmc.org/abstract/MED/15836366

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1 March 2005

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10 January 2020

Journal of Chemical Physics

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10 January 2020

122

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10 January 2020

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10 January 2020

124104

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10 January 2020

Full configuration interaction potential energy curves for the X (1)Sigma(g) (+), B (1)Delta(g), and B(') (1)Sigma(g) (+) states of C(2): a challenge for approximate methods.

1 reference

https://api.crossref.org/works/10.1063%2F1.1867379

21 January 2018

On the Correlation Problem in Atomic and Molecular Systems. Calculation of Wavefunction Components in Ursell‐Type Expansion Using Quantum‐Field Theoretical Methods

1 reference

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21 January 2018

A fifth-order perturbation comparison of electron correlation theories

1 reference

https://api.crossref.org/works/10.1063%2F1.1867379

21 January 2018

New coupled-cluster methods with singles, doubles, and noniterative triples for high accuracy calculations of excited electronic states.

1 reference

https://api.crossref.org/works/10.1063%2F1.1867379

21 January 2018

Higher-order equation-of-motion coupled-cluster methods.

1 reference

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21 January 2018

The construction and interpretation of MCSCF wavefunctions

1 reference

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21 January 2018

Balancing dynamic and nondynamic correlation for diradical and aromatic transition states: a renormalized coupled-cluster study of the cope rearrangement of 1,5-hexadiene

1 reference

https://api.crossref.org/works/10.1063%2F1.1867379

21 January 2018

Combined coupled-cluster and many-body perturbation theories

1 reference

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21 January 2018

General atomic and molecular electronic structure system

1 reference

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21 January 2018

Improved computational strategy for the state‐selective coupled‐cluster theory with semi‐internal triexcited clusters: Potential energy surface of the HF molecule

1 reference

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21 January 2018

A comparison of the renormalized and active-space coupled-cluster methods: Potential energy curves of BH and F2

1 reference

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21 January 2018

The equation of motion coupled‐cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state properties

1 reference

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21 January 2018

A full coupled‐cluster singles and doubles model: The inclusion of disconnected triples

1 reference

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21 January 2018

Coupled cluster response functions

1 reference

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21 January 2018

The method of moments of coupled-cluster equations and the renormalized CCSD[T], CCSD(T), CCSD(TQ), and CCSDT(Q) approaches

1 reference

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21 January 2018

The active-space equation-of-motion coupled-cluster methods for excited electronic states: Full EOMCCSDt

1 reference

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21 January 2018

A state‐selective multireference coupled‐cluster theory employing the single‐reference formalism

1 reference

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21 January 2018

The closed‐shell coupled cluster single and double excitation (CCSD) model for the description of electron correlation. A comparison with configuration interaction (CISD) results

1 reference

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21 January 2018

An efficient closed-shell singles and doubles coupled-cluster method

1 reference

https://api.crossref.org/works/10.1063%2F1.1867379

21 January 2018

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