"Extension of the PDDG/PM3 and PDDG/MNDO semiempirical molecular orbital ..."

Ivan Tubert-Brohman et al. (2004)

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DOI: 10.1002/JCC.10356

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type: Journal Article

metadata version: 2020-05-30

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Ivan Tubert-Brohman, Cristiano Ruch Werneck Guimarães, Matthew P. Repasky, William L. Jorgensen:
Extension of the PDDG/PM3 and PDDG/MNDO semiempirical molecular orbital methods to the halogens. J. Comput. Chem. 25(1): 138-150 (2004)

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