NWChem functionality

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Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups
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Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
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Edoapra

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Multiple constained DFT
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dispersion correction in plane wave
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Time-limit
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Implementation of PBE0 functional in NWCHEM
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Verify the expression: C.transpose * S * C = I
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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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Roothaan equation (F*C = S*C*E)
 1 3274 Jul 22nd 11:01 am
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Forum >> NWChem's corner >> NWChem functionality
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