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COLLEGE OF ARTS AND SCIENCES OFFICE OF RESEARCH
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Research Computing Center
University of South Carolina
712 Main St.
PSC 109
Columbia, SC 29208

Fax: 803-777-9385

 

MOLPRO Quantum Chemistry Package

MOLPRO is a complete system of ab initio programs for molecular electronic structure calculations.  The emphasis is on highly accurate computations, with extensive treatment of the electron correlation problem through the multiconfiguration-reference CI, coupled cluster and associated methods.

DOCUMENTATION
Application Homepage

PRIMARY CONTACT
Prof. Robert C. Sharpley
Prof. Daniel B. Dix
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