Invariance criteria and symmetry conservation rules for geometry optimizations
Author:
Publisher
Springer Science and Business Media LLC
Subject
Chiropractics,Physical and Theoretical Chemistry
Link
http://link.springer.com/content/pdf/10.1007/BF00550282.pdf
Reference24 articles.
1. Slanina, Z., Schlanger, J., Zahradnik, R.: Coll. Czechoslov. Chem. Commun. 41, 1864 (1976)
2. Collins, J. B., Schleyer, P. v. R., Binkley, J. S., Pople, J. A.: J. Chem. Phys. 64, 5142 (1976)
3. Dewar, M. J. S., Ford, G. P.: J. Am. Chem. Soc. 99, 1685 (1977)
4. Catal�n, J., Macias, A.: J. Mol. Struct. 38, 209 (1977)
5. McIver Jr., J. W., Komornicki, A.: Chem. Phys. Letters 10, 303 (1971)
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