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Effect of electron correlation of theoretical equilibrium geometries. 2. Comparison of third-order perturbation and configuration interaction results with experiment
DeFrees, Douglas J., Raghavachari, Krishnan, Schlegel, H. Bernhard, Pople, John A.Volume:
104
Language:
english
Journal:
Journal of the American Chemical Society
DOI:
10.1021/ja00385a002
Date:
October, 1982
File:
PDF, 595 KB
english, 1982