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1
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Ab initio molecular dynamics : basic theory and advanced methods /
Marx
,
Dominik
2012
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Dominik
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IAS-9
Name
Hutter, Jürg
1
Marx, Dominik
1
Subject
ab initio calculation
1
computer simulation
1
molecular dynamics calculation
1
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CHO - Electronic structure of molecules, molecular orbitals, ligand field theory
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