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5 Replies
13070 Views |
![]() by ylniu |
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Combining population analysis and ricc2.
Started by Addiw7 |
0 Replies
4554 Views |
![]() by Addiw7 |
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4 Replies
14893 Views |
![]() by JakubV |
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transition dipole moment
Started by arek1arek |
3 Replies
8868 Views |
![]() by christof.haettig |
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TDDFT excited state optimization fails
Started by basklau |
2 Replies
10376 Views |
![]() by JakubV |
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1 Replies
6734 Views |
![]() by uwe |
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2 Replies
7314 Views |
![]() by biophys2012 |
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6 Replies
9212 Views |
![]() by Hauke |
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3 Replies
7173 Views |
![]() by antti_karttunen |
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Parallel version?
Started by cb |
1 Replies
6626 Views |
![]() by turbomaster |
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uncoupled polarizabilities
Started by ccsdt |
1 Replies
5873 Views |
![]() by christof.haettig |
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escf for open-shell
Started by cdicker2 |
2 Replies
1528 Views |
![]() by cdicker2 |
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Symmetry of excited states
Started by dcav |
0 Replies
3543 Views |
![]() by dcav |
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1 Replies
8265 Views |
![]() by antti_karttunen |
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2 Replies
7616 Views |
![]() by Stephan |
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3 Replies
6278 Views |
![]() by e.berardo |
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not enough core memory escf
Started by e.berardo |
3 Replies
6186 Views |
![]() by e.berardo |
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3 Replies
6460 Views |
![]() by christof.haettig |
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Egrad with TPSSH-functional
Started by fkreu |
1 Replies
1555 Views |
![]() by Arnim |
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can escf run in parallel?
Started by golden |
1 Replies
4447 Views |
![]() by antti_karttunen |
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