Time-dependent N-electron valence perturbation theory with matrix product state reference wavefunctions for large active spaces and basis sets: Applications to the chromium dimer and all-trans polyenes

Ronca, Enrico; Chan, Garnet Kin-Lic; Sokolov, Alexander Yu.; Guo, Sheng Lian

doi:10.1063/1.4986975

Record: found
Abstract: not found
Article: not found

Time-dependent N-electron valence perturbation theory with matrix product state reference wavefunctions for large active spaces and basis sets: Applications to the chromium dimer and all-trans polyenes

Author(s): Alexander Yu. Sokolov ¹ , Sheng Guo ¹ , Enrico Ronca ¹ , Garnet Kin-Lic Chan ¹

Publication date Created: June 28 2017

Publication date (Print): June 28 2017

Journal: The Journal of Chemical Physics

Publisher: AIP Publishing

Read this article at

ScienceOpenPublisher

Bookmark

There is no author summary for this article yet. Authors can add summaries to their articles on ScienceOpen to make them more accessible to a non-specialist audience.

Related collections

Most cited references 83

Record: found
Abstract: not found
Article: not found

An efficient internally contracted multiconfiguration–reference configuration interaction method

Peter J. Knowles, Hans-Joachim Werner (1988)

0 comments Cited 851 times – based on 0 reviews      Review now

Bookmark

Record: found
Abstract: not found
Article: not found

Second‐order perturbation theory with a complete active space self‐consistent field reference function

Kerstin Andersson, Per-Åke Malmqvist, Björn O. Roos (1992)

0 comments Cited 731 times – based on 0 reviews      Review now

Bookmark

Record: found
Abstract: not found
Article: not found

Introduction ofn-electron valence states for multireference perturbation theory

C Angeli, J.-P. Malrieu, T. Leininger … (2001)

0 comments Cited 332 times – based on 0 reviews      Review now

Bookmark

All references

Author and article information

Journal

Title: The Journal of Chemical Physics

Abbreviated Title: The Journal of Chemical Physics

Publisher: AIP Publishing

ISSN (Print): 0021-9606

ISSN (Electronic): 1089-7690

Publication date Created: June 28 2017

Publication date (Print): June 28 2017

Volume: 146

Issue: 24

Page: 244102

Affiliations

[1 ]Division of Chemistry and Chemical Engineering, California Institute of Technology, Pasadena, California 91125, USA

Article

DOI: 10.1063/1.4986975

SO-VID: a547ebdb-edf1-4c29-9540-2cce258c3b99

License:

https://publishing.aip.org/authors/rights-and-permissions

History

Data availability:

Time-dependent N-electron valence perturbation theory with matrix product state reference wavefunctions for large active spaces and basis sets: Applications to the chromium dimer and all-trans polyenes

Read this article at

Related collections

Active Travel Studies

Most cited references 83

An efficient internally contracted multiconfiguration–reference configuration interaction method

Second‐order perturbation theory with a complete active space self‐consistent field reference function

Introduction ofn-electron valence states for multireference perturbation theory

Author and article information

Journal

Affiliations

Article

History

Comments

Comment on this article

Similar content 493

Cited by 13

Most referenced authors 1,523