NWChem functionality

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups
 0 1715 Jun 18th 5:01 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
 0 13620 Dec 14th 2:51 pm
Edoapra

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dispersion correction in plane wave
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incomplete atomic overlap matrix output from "print "overlap" "
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Cartesian gaussian functions used in NWChem
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overlap matrix of atomic orbitals
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pressure in thermo calculations
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Plot atomic orbitals
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Spherical vs cartesian basis sets
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A question about MP2 energy gradient
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Jhammond

Forum >> NWChem's corner >> NWChem functionality
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