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Combining population analysis and ricc2.
Started by Addiw7 |
0 Replies
4552 Views |
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TDDFT with B97-3c
Started by luyj |
0 Replies
1634 Views |
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Spin-Orbit coupling
Started by plato |
0 Replies
6285 Views |
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electrostatic properties of excited states
Started by plato |
0 Replies
5410 Views |
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0 Replies
2978 Views |
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0 Replies
4687 Views |
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gradient evaluation error
Started by wasif |
0 Replies
3481 Views |
![]() by wasif |
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TDDFT cosmo
Started by jbaltrus |
0 Replies
4480 Views |
![]() by jbaltrus |
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Subsequent Escf runs - How to?
Started by marcen |
0 Replies
3283 Views |
![]() by marcen |
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twoint empty
Started by jbaltrus |
0 Replies
3959 Views |
![]() by jbaltrus |
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Symmetry of excited states
Started by dcav |
0 Replies
3542 Views |
![]() by dcav |
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Temperature of Raman scatt. cross sections
Started by Punix |
0 Replies
3745 Views |
![]() by Punix |
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0 Replies
4160 Views |
![]() by Xiaoyan |
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0 Replies
4476 Views |
![]() by martijn |
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How can I get transition density?
Started by ylniu |
0 Replies
5777 Views |
![]() by ylniu |
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COSMO and TDDFT
Started by oana |
0 Replies
5127 Views |
![]() by oana |
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0 Replies
5580 Views |
![]() by wiking |
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hyperpolarizability
Started by onthefly |
0 Replies
5998 Views |
![]() by onthefly |
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0 Replies
4726 Views |
![]() by Leprechaum |
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How to switch off the XC kernel?
Started by JohnZhou_case |
0 Replies
580 Views |
![]() by JohnZhou_case |
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