Adaptive resolution molecular dynamics simulation through coupling to an internal particle reservoir

Physical Review Letters

Volumn 108, Issue 17, 2012, Pages

  Fritsch, S ^a   Poblete, S ^a   Junghans, C ^a,e   Ciccotti, G ^b,c   Delle Site, L ^a,d   Kremer, K ^a  

^a MAX PLANCK INSTITUTE FOR POLYMER RESEARCH   (Germany)

^b UNIVERSITY COLLEGE DUBLIN   (Ireland)

^c SAPIENZA UNIVERSITY OF ROME   (Italy)

^d FREIE UNIVERSITÄT BERLIN   (Germany)

^e LOS ALAMOS NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADAPTIVE RESOLUTION; AMBIENT CONDITIONS; GRAND CANONICAL; LIQUID WATER; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR LIQUIDS; PARTICLE RESERVOIRS; SIMULATION STUDIES;

MOLECULAR DYNAMICS;

RESERVOIRS (WATER);

EID: 84860335352     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.108.170602     Document Type: Article

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