Hydrogen bond. Environmental effects on
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O. Tapia; E. Poulain; F. Sussman
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Article
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1975
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Elsevier Science
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English
β 590 KB
A solvent and/or environmental effect has been introduced into the MO CND0/2 calculation af a model hydrogen bonded system. Proton potential curves, potential energy, dipole moments, the polvizability component parallel to the reaction field, and the second order perturbation effects associated to t