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EPLF

Electron Pair Localization Function

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Description

The Electron Pair Localization Function (EPLF) helps to understand chemical bonding in molecular systems. This code uses a modified formulation which allows the exact calculation of the EPLF for usual wave functions (HF,KS,CAS,...)

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Additional Project Details

Intended Audience

Science/Research

Programming Language

Fortran

Registered

2009-09-29

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