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A streamlined molecular-dynamics workflow for computing solubilities of molecular and ionic crystals. (2023)

First Author: Reinhardt A
Attributed to:  Peta-5: A National Facility for Petascale Data Intensive Computation and Analytics funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1063/5.0173341

PubMed Identifier: 37962445

Publication URI: http://europepmc.org/abstract/MED/37962445

Type: Journal Article/Review

Volume: 159

Parent Publication: The Journal of chemical physics

Issue: 18

ISSN: 0021-9606