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G2 study of triplet [H4, Si, P]+ potential energy surface: Mechanism for reaction of P+ (3P) with silane.
Elso M. Cruz
Xabier Lopez
Martín Sarobe
Fernando P. Cossío
Jesus M. Ugalde
Published in:
J. Comput. Chem. (1997)
Keyphrases
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peer to peer
empirical studies
data sets
genetic algorithm
d objects
vector field
energy minimization
geodesic distance