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Automatic generation of active coordinates for quantum dynamics calculations: application to the dynamics of benzene photochemistry
Lasorne, Benjamin; Sicilia, Fabrizio; Bearpark, Michael J.; Robb, Michael A.; Worth, Graham A.; Blancafort San José, Lluís
2011-03-22
Benzè
Camp autoconsistent, Teoria del
Fotoquímica
Quàntums, Teoria dels
Benzene
Photochemistry
Quantum theory
Self-consistent field theory
Tots els drets reservats
Article
American Institute of Physics
         

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