Questions
| Topic | Replies | Views | Activity | |
|---|---|---|---|---|
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Using AMOEBA on Q-Chem (or interface Tinker/Q-Chem)
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3 | 940 | October 30, 2020 |
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How to run Q-Chem on Azure Cloud
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1 | 956 | October 30, 2020 |
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Q-Chem fatal error occurred in module 0 and forms2/ShlPairs.C
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5 | 2357 | October 28, 2020 |
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Insuffcient virtual memory
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2 | 951 | October 23, 2020 |
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Composite QM methods
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1 | 646 | October 11, 2020 |
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Unable to allocate requested memory in mega_alloc
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1 | 1092 | October 10, 2020 |
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AIMD for reaction
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2 | 849 | October 9, 2020 |
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How to set up a QM/MM-Ewald calculation
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1 | 842 | September 8, 2020 |
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QM/MM energies within ONIOM and Janus schemes
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2 | 1057 | September 4, 2020 |
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QM/MM optimization
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3 | 930 | August 11, 2020 |
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Size of molecular systems for NTOs analysis in TPA
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6 | 774 | August 10, 2020 |
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Is FNO approximation applicable to EOM-EE-CCSD?
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2 | 696 | July 7, 2020 |
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Resonances with projected-CAP
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1 | 596 | July 7, 2020 |
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What to do if Q-Chem can't determine orbital irrep?
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1 | 1535 | July 5, 2020 |
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How to plot diffuse orbitals in IQmol?
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1 | 840 | July 4, 2020 |