THE JOURNAL OF CHEMICAL PHYSICS 122, 054112 共2005兲 Targeted Car–Parrinello molecular dynamics: Elucidating double proton transfer in formic acid dimer Phineus R. L. Markwicka) European Molecular Biology Laboratory

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Date: 2006-03-03 05:47:42 Chemistry Physics Nature Computational chemistry Computational physics Mathematical optimization Molecular dynamics Molecular modelling Scientific modeling Generalized coordinates TG Lagrange multiplier		THE JOURNAL OF CHEMICAL PHYSICS 122, 054112 共2005兲 Targeted Car–Parrinello molecular dynamics: Elucidating double proton transfer in formic acid dimer Phineus R. L. Markwicka) European Molecular Biology Laboratory Add to Reading List Source URL: ftp.theochem.ruhr-uni-bochum.de Download Document from Source Website File Size: 234,62 KB Share Document on Facebook

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