"A comparative study of molecular dynamics in Cartesian and in internal ..."

Sang-Ho Lee, Kim Palmö, Samuel Krimm (2007)

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DOI: 10.1002/JCC.20627

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type: Journal Article

metadata version: 2020-04-01

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Sang-Ho Lee, Kim Palmö, Samuel Krimm:
A comparative study of molecular dynamics in Cartesian and in internal coordinates: Dynamical instability in the latter caused by nonlinearity of the equations of motion. J. Comput. Chem. 28(6): 1107-1118 (2007)

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