Time reversible molecular dynamics algorithms with holonomic bond constraints in the NPH and NPT ensembles using molecular scaling

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@article{2d6901804be311dfa130000ea68e967b,

title = "Time reversible molecular dynamics algorithms with holonomic bond constraints in the NPH and NPT ensembles using molecular scaling",

author = "Trond Ingebrigtsen and S{\o}ren Toxv{\ae}rd and Dyre, {J. C.}",

year = "2010",

doi = "10.1063/1.3363609",

language = "English",

volume = "132",

pages = "154106--01 til 154106--08",

journal = "Journal of Chemical Physics",

issn = "0021-9606",

publisher = "American Institute of Physics",

}

TY - JOUR

T1 - Time reversible molecular dynamics algorithms with holonomic bond constraints in the NPH and NPT ensembles using molecular scaling

AU - Ingebrigtsen, Trond

AU - Toxværd, Søren

AU - Dyre, J. C.

PY - 2010

Y1 - 2010

U2 - 10.1063/1.3363609

DO - 10.1063/1.3363609

M3 - Journal article

SN - 0021-9606

VL - 132

SP - 154106-01 til 154106-08

JO - Journal of Chemical Physics

JF - Journal of Chemical Physics

ER -