About: Dielectric properties of solids in the regular and split-charge equilibration formalisms

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scholarly article in Physical Review B, vol. 79 no. 10, March 2009

Attributes	Values
rdf:type	Item
description	wetenschappelijk artikel (nl) article scientifique publié en 2009 (fr) наукова стаття, опублікована в березні 2009 (uk) im März 2009 veröffentlichter wissenschaftlicher Artikel (de) scholarly article in Physical Review B, vol. 79 no. 10, March 2009 (en)
publication date	wds:Q58200987-5BB5A3FD-D17B-481B-8671-484FDD02DD08
publication date	2009-03-24 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q58200987-1D6A0C22-9092-4460-A092-0AB566BA0D85
language of work or name	English
cites work	wds:Q58200987-05AE163D-2C63-4477-9F16-E6914D062D8C wds:Q58200987-1058515F-C778-40B7-836C-CED6FA6C044A wds:Q58200987-1A2897B2-72F4-461C-80D9-9B8A469B61E6 wds:Q58200987-29ABAF52-E6C8-4AC3-8049-52A82E673678 wds:Q58200987-41F7C5C9-E29A-4873-B790-1591AFE1731B wds:Q58200987-79B667A9-9359-4845-BE7E-751BE641697B wds:Q58200987-955B9E62-0FEB-42E5-AD1B-9DAE6B29D93C wds:Q58200987-A0B6C7F1-224C-46D7-B041-6708C9C7223E wds:Q58200987-C22EAE07-A861-4E8B-802F-3F9E1C224790
cites work	CHARMM fluctuating charge force field for proteins: I parameterization and application to bulk organic liquid simulations. Force fields for protein simulations A generalization of the charge equilibration method for nonmetallic materials Absolute hardness: companion parameter to absolute electronegativity ReaxFF: A Reactive Force Field for Hydrocarbons QTPIE: Charge transfer with polarization current equalization. A fluctuating charge model with correct asymptotics Origin and control of superlinear polarizability scaling in chemical potential equalization methods Reverse Monte Carlo Simulation: A New Technique for the Determination of Disordered Structures Classical Fluctuating Charge Theories: The Maximum Entropy Valence Bond Formalism and Relationships to Previous Models†
author name string	wds:Q58200987-45F18E6E-7A61-460E-9386-E11155E4EE17 wds:Q58200987-AED41878-E339-48C2-813D-AECB8E410902
author name string	Martin H. Müser Razvan A. Nistor
rdfs:label	Dielectric properties of solids in the regular and split-charge equilibration formalisms (en) Dielectric properties of solids in the regular and split-charge equilibration formalisms (nl)
skos:prefLabel	Dielectric properties of solids in the regular and split-charge equilibration formalisms (en) Dielectric properties of solids in the regular and split-charge equilibration formalisms (nl)
name	Dielectric properties of solids in the regular and split-charge equilibration formalisms (en) Dielectric properties of solids in the regular and split-charge equilibration formalisms (nl)
title	wds:Q58200987-9741949D-CACD-4158-A65B-A73946DBAE06
title	Dielectric properties of solids in the regular and split-charge equilibration formalisms (en)
instance of	wds:Q58200987-7EFF7ED7-C181-47F9-BA73-98A01743AF86
instance of	scholarly article
published in	wds:Q58200987-1D8FD305-01DC-4546-9963-0E06EDA0DEB7
published in	Physical Review B
issue	wds:Q58200987-2C46E792-55CA-44AF-BA5F-F86746D8FDE9
volume	wds:Q58200987-814F6F1C-4829-42C7-AC6F-015C63ADD49D
issue	10
volume	79
DOI	wds:Q58200987-DF295AD3-C67B-41A2-A68B-53BFA7A6D025
DOI	http://dx.doi.org/10.1103/PHYSREVB.79.104303
DOI	10.1103/PHYSREVB.79.104303
is owl:sameAs of	Dielectric properties of solids in the regular and split-charge equilibration formalisms
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q58200987
is cites work of	Interplay between the ionic and electronic transport and its effects on the reaction pattern during the electrochemical conversion in an FeF2 nanoparticle. The chemical hardness of molecules and the band gap of solids within charge equilibration formalisms Redox reactions with empirical potentials: Atomistic battery discharge simulations ACKS2: atom-condensed Kohn-Sham DFT approximated to second order. Direct computation of parameters for accurate polarizable force fields. Towards time-dependent, non-equilibrium charge-transfer force fields
is cites work of	wds:Q58200957-1040E877-173D-4FB5-A746-3882389D17F0 wds:Q53555948-C92C6988-7159-48FC-8B22-8B3708315074 wds:Q58200946-25652B44-4218-4E89-AD21-A300D6215B4A wds:Q49035189-E6195C6A-B7DC-4C04-976E-E12D64125166 wds:Q58200948-7D80B5B8-47EE-4EA5-BF21-D9EDA4627A61 wds:Q49134445-A24BC4AA-0059-445C-BCCA-6F4631823E85

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