Quantum thermal bath for molecular dynamics simulation

Molecular dynamics (MD) is a numerical simulation technique based on classical mechanics. It has been taken for granted that its use is limited to a large temperature regime where classical statistics is valid. To overcome this limitation, the authors introduce in a universal way a quantum thermal b...

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Veröffentlicht in:	Physical review letters 2009-11, Vol.103 (19), p.190601-190601, Article 190601
Hauptverfasser:	Dammak, Hichem, Chalopin, Yann, Laroche, Marine, Hayoun, Marc, Greffet, Jean-Jacques
Format:	Artikel
Sprache:	eng
Schlagworte:	Optics Physics
Online-Zugang:	Volltext
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