Your browser doesn't support javascript.
loading
Ab initio random structure searching of organic molecular solids: assessment and validation against experimental data.
Zilka, Miri; Dudenko, Dmytro V; Hughes, Colan E; Williams, P Andrew; Sturniolo, Simone; Franks, W Trent; Pickard, Chris J; Yates, Jonathan R; Harris, Kenneth D M; Brown, Steven P.
Afiliação
  • Zilka M; Department of Physics, University of Warwick, Coventry CV4 7AL, UK. S.P.Brown@warwick.ac.uk.
  • Dudenko DV; Department of Physics, University of Warwick, Coventry CV4 7AL, UK. S.P.Brown@warwick.ac.uk and School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, UK. HarrisKDM@cardiff.ac.uk.
  • Hughes CE; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, UK. HarrisKDM@cardiff.ac.uk.
  • Williams PA; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, UK. HarrisKDM@cardiff.ac.uk.
  • Sturniolo S; Scientific Computing Department, Rutherford Appleton Laboratory, Chilton, Didcot, Oxfordshire OX11 0QX, UK.
  • Franks WT; Department of Physics, University of Warwick, Coventry CV4 7AL, UK. S.P.Brown@warwick.ac.uk.
  • Pickard CJ; Department of Materials Science & Metallurgy, University of Cambridge, 27 Charles Babbage Road, Cambridge CB3 0FS, UK.
  • Yates JR; Department of Materials, University of Oxford, Oxford OX1 3PH, UK. Jonathan.Yates@materials.ox.ac.uk.
  • Harris KDM; School of Chemistry, Cardiff University, Park Place, Cardiff CF10 3AT, UK. HarrisKDM@cardiff.ac.uk.
  • Brown SP; Department of Physics, University of Warwick, Coventry CV4 7AL, UK. S.P.Brown@warwick.ac.uk.
Phys Chem Chem Phys ; 19(38): 25949-25960, 2017 Oct 04.
Article em En | MEDLINE | ID: mdl-28944393
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Clinical_trials Idioma: En Ano de publicação: 2017 Tipo de documento: Article
Texto completo
Imprimir
XML
PubMed Links
Buscar no Google

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Clinical_trials Idioma: En Ano de publicação: 2017 Tipo de documento: Article