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34.1 The property program
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34 PROPERTIES AND EXPECTATION VALUES
Subsections
34.1 The property program
34.2 Distributed multipole analysis
34.3 Mulliken population analysis
34.4 Natural Bond Orbital Analysis
34.5 Finite field calculations
34.6 Relativistic corrections
34.7 CUBE -- dump density or orbital values
34.8 GOPENMOL -- calculate grids for visualization in gOpenMol
molpro@molpro.net 2012-02-05
