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Egrad with TPSSH-functional
Started by fkreu |
1 Replies
4580 Views |
![]() by Arnim |
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can escf run in parallel?
Started by golden |
1 Replies
6068 Views |
![]() by antti_karttunen |
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1 Replies
6645 Views |
![]() by antti_karttunen |
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TDDFT calculations using b3-lyp functional
Started by golden |
1 Replies
8217 Views |
![]() by Christof |
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egrad density difference (ed.plt)
Started by Helph |
2 Replies
5465 Views |
![]() by Helph |
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Abnormal termination of egrad
Started by jakob |
1 Replies
6979 Views |
![]() by uwe |
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Escf for 2c- (spin-orbit) SCF/DFT
Started by JakubV |
3 Replies
4696 Views |
![]() by chris.hol |
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TDDFT cosmo
Started by jbaltrus |
0 Replies
6126 Views |
![]() by jbaltrus |
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twoint empty
Started by jbaltrus |
0 Replies
5605 Views |
![]() by jbaltrus |
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problems with S1 optimization
Started by jc3 |
1 Replies
8030 Views |
![]() by Arnim |
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EGRAD and NBO
Started by jchackett |
1 Replies
7097 Views |
![]() by Arnim |
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2 Replies
7336 Views |
![]() by Jerry |
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How to switch off the XC kernel?
Started by JohnZhou_case |
0 Replies
4844 Views |
![]() by JohnZhou_case |
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1 Replies
7496 Views |
![]() by christof.haettig |
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0 Replies
6345 Views |
![]() by kmlin |
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Strange excitations while using desy
Started by Kwiatkowski |
1 Replies
6144 Views |
![]() by christof.haettig |
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0 Replies
6302 Views |
![]() by Leprechaum |
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1 Replies
6411 Views |
![]() by christof.haettig |
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1 Replies
11093 Views |
![]() by dimi |
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singlet excitation
Started by lsikk |
4 Replies
11362 Views |
![]() by lsikk |
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