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Pages: 1
| Topic | Forum | Replies | Last post |
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1
BSSE corrected binding Gibbs free energies by Abdullah
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Quantum Chemistry | 17 | 2022-08-25 15:32:52 by behnam12 |
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2
frequency scaling factor sclZPE for Shermo by Abdullah
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Quantum Chemistry | 2 | 2022-04-13 23:26:02 by EspenEriksrud |
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3
Interaction energy and binding energy by Abdullah
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Quantum Chemistry | 6 | 2022-03-05 23:02:25 by Abdullah |
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4 |
Quantum Chemistry | 2 | 2021-12-09 06:50:21 by Abdullah |
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5
atom size in VMD by Abdullah
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Quantum Chemistry | 2 | 2021-10-01 10:52:16 by Abdullah |
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6
exporting log file to gjf by Abdullah
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Multiwfn and wavefunction analysis | 1 | 2021-02-16 07:36:18 by sobereva |
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7
Gibbs free energy of single atom in ORCA by Abdullah
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Quantum Chemistry | 12 | 2021-02-10 06:42:50 by Abdullah |
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8
AuxJK basis functions in ORCA by Abdullah
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Quantum Chemistry | 4 | 2021-01-30 11:29:00 by Abdullah |
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9
HOMO LUMO gap of open shell molecule by Abdullah
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Quantum Chemistry | 2 | 2021-01-28 17:04:02 by Abdullah |
Pages: 1