Analytical nuclear gradients for the range-separated many-body dispersion model of noncovalent interactions
نویسندگان
چکیده
Department of Chemistry and Chemical Bio USA. E-mail: [email protected] Department of Chemistry, Princeton Univer Department of Chemistry and Chemical Bio Princeton Institute for the Science and Tech Princeton, NJ, USA Department of Physics, Princeton University Program in Applied and Computational Mat NJ, USA † Electronic supplementary information additional derivation details, a compreh coordinates for all structures cons 10.1039/c5sc03234b ‡ These authors contributed equally to th Cite this: Chem. Sci., 2016, 7, 1712
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