Frozen-density embedding theory with average solvent charge densities from explicit atomistic simulations
ContributorsLaktionov, Andréy; Chalaye, Emilie; Wesolowski, Tomasz Adam
Published inPCCP. Physical chemistry chemical physics, vol. 18, no. 31, p. 21069-21078
Publication date2016
Abstract
Research group
Citation (ISO format)
LAKTIONOV, Andréy, CHALAYE, Emilie, WESOLOWSKI, Tomasz Adam. Frozen-density embedding theory with average solvent charge densities from explicit atomistic simulations. In: PCCP. Physical chemistry chemical physics, 2016, vol. 18, n° 31, p. 21069–21078. doi: 10.1039/C6CP00497K
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Article (Published version)
Identifiers
- PID : unige:86906
- DOI : 10.1039/C6CP00497K
Commercial URLhttp://xlink.rsc.org/?DOI=C6CP00497K
ISSN of the journal1463-9076