Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration and structural properties

Michael Patra; Mikko Karttunen

Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration and structural properties

Michael Patra, Mikko Karttunen

Research output: Contribution to journal › Article › Scientific › peer-review

186 Citations (Scopus)

Original language	English
Pages (from-to)	678-689
Journal	JOURNAL OF COMPUTATIONAL CHEMISTRY
Volume	25
Issue number	5
Publication status	Published - 2004
MoE publication type	A1 Journal article-refereed

Access to Document

http://arxiv.org/abs/physics/0211059

Cite this

@article{6228599191774222b67f20b404bbd51f,

title = "Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration and structural properties",

author = "Michael Patra and Mikko Karttunen",

year = "2004",

language = "English",

volume = "25",

pages = "678--689",

journal = "JOURNAL OF COMPUTATIONAL CHEMISTRY",

issn = "0192-8651",

publisher = "John Wiley and Sons Inc.",

number = "5",

}

TY - JOUR

T1 - Systematic comparison of force fields for microscopic simulations of NaCl in aqueous solutions: Diffusion, free energy of hydration and structural properties

AU - Patra, Michael

AU - Karttunen, Mikko

PY - 2004

Y1 - 2004

UR - http://arxiv.org/abs/physics/0211059

M3 - Article

VL - 25

SP - 678

EP - 689

JO - JOURNAL OF COMPUTATIONAL CHEMISTRY

JF - JOURNAL OF COMPUTATIONAL CHEMISTRY

SN - 0192-8651

IS - 5

ER -