A comparison of united atom, explicit atom, and coarse-grained simulation models for poly(ethylene oxide)

Journal of Chemical Physics

Volumn 124, Issue 23, 2006, Pages

  Chen, Chunxia ^a   Depa, Praveen ^a   Sakai, Victoria García ^b   Maranas, Janna K ^a   Lynn, Jeffrey W ^c   Peral, Inmaculada ^b,d   Copley, John R D ^c  

^a The Pennsylvania State University   (United States)

^b UNIVERSITY OF MARYLAND   (United States)

^c NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY   (United States)

^d UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

COARSE-GRAINED (CG); EXPLICIT ATOM (EA); NEUTRON DECAY; UNITED ATOM (UA);

COMPUTER SIMULATION; CRYSTAL MICROSTRUCTURE; DYNAMIC RESPONSE; HYDROGEN; MATHEMATICAL MODELS; NEUTRON DIFFRACTION; NUCLEAR MAGNETIC RESONANCE;

POLYETHYLENE OXIDES;

EID: 33745290416     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2204035     Document Type: Article

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