dc.contributor.author
Loche, Philip
dc.contributor.other
Steinbrunner, Patrick
dc.contributor.other
Friedowitz, Sean
dc.contributor.other
Netz, Roland R.
dc.contributor.other
Bonthuis, Douwe Jan
dc.date.accessioned
2021-07-12T09:30:20Z
dc.date.available
2021-07-12T09:30:20Z
dc.identifier.uri
https://refubium.fu-berlin.de/handle/fub188/31152
dc.identifier.uri
http://dx.doi.org/10.17169/refubium-30888
dc.description.abstract
This document contains the molecular dynamics simulation files, the developed force field files for the GROMACS simulation toolkit and the analysis files used in "Transferable ion force fields in water from simultaneous optimization of ion solvation and ion-ion interaction".
en
dc.publisher
Freie Universität Berlin
dc.rights.uri
https://creativecommons.org/licenses/by/4.0/
dc.subject
molecular dynamics
en
dc.subject.ddc
500 Naturwissenschaften und Mathematik::530 Physik::530 Physik
dc.title
Transferable ion force fields in water from simultaneous optimization of ion solvation and ion-ion interaction
dc.contributor.type
data_collector
dc.contributor.type
project_leader
refubium.affiliation
Physik
refubium.affiliation.other
Institut für Theoretische Physik
refubium.funding.funder
dfg
refubium.funding.project
SFB 1349
refubium.isSupplementTo.doi
https://doi.org/10.17169/refubium-32810
refubium.isSupplementTo.url
https://doi.org/10.1021/acs.jpcb.1c05303
dcterms.accessRights.openaire
open access
