The molecular gradient using the divide-expand-consolidate resolution of the identity second-order Møller-Plesset perturbation theory: The DEC-RI-MP2 gradient. [electronic resource]

By: Contributor(s): Producer: 20170125Description: 024106 p. digitalISSN:
  • 1089-7690
Online resources: In: The Journal of chemical physics vol. 145
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Publication Type: Journal Article

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