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The top documents tagged [qm methods]
Technology
2011 US Combustion Meeting - Kinetic Modeling of Methyl Formate Oxidation
1.223 views
Documents
Bias Correction
87 views
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CONTENT Doing Chemistry with Computers Description of the tools - classical and quantum models - dynamics - QM/MM: computation in a complex envirnoment
216 views
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The ONIOM Method in Gaussian 03
150 views