Unbiased reduced density matrices and electronic properties from full configuration interaction quantum Monte Carlo.

View / Open Files

Accepted version (PDF, 301Kb)

Authors

Overy, Catherine

  Booth, George H

  Blunt, Nicholas

  Shepherd, James J

  Cleland, Deidre

  Alavi, Ali

Publication Date

2014-12

Journal Title

The Journal of chemical physics

ISSN

0021-9606

Volume

141

Issue

24

Pages

244117

Language

eng

Type

Article

Physical Medium

Print

Metadata

Show full item record

Citation

Overy, C., Booth, G. H., Blunt, N., Shepherd, J. J., Cleland, D., & Alavi, A. (2014). Unbiased reduced density matrices and electronic properties from full configuration interaction quantum Monte Carlo.. The Journal of chemical physics, 141 (24), 244117. https://doi.org/10.1063/1.4904313

Sponsorship

EPSRC (EP/J003867/1)

Identifiers

External DOI: https://doi.org/10.1063/1.4904313

This record's URL: https://www.repository.cam.ac.uk/handle/1810/285074



Rights

Licence:

http://www.rioxx.net/licenses/all-rights-reserved