General Questions 123 topics

This is the place where you can put general questions/inquiries about MRCC related things.

Subject	Replies / Views	Last Post
Contents of the fort.* files Category: General Questions Topic started 5 years 11 months ago, by Nike Last Post 5 years 11 months ago by kallay	Replies:3 Views:3192	Last Post by kallay 5 years 11 months ago
Error reading DOMAIN in ovirt Category: General Questions Topic started 6 years 4 days ago, by embcp-19 Last Post 6 years 3 days ago by embcp-19 1 2	Replies:6 Views:6057	Last Post by embcp-19 6 years 3 days ago
Columbus Interface Category: General Questions Topic started 6 years 1 week ago, by rayxalapa Last Post 6 years 1 week ago by rayxalapa	Replies:0 Views:4390	Last Post by rayxalapa 6 years 1 week ago
analytic gradients for LMP2 Category: General Questions Topic started 6 years 2 weeks ago, by sharley Last Post 6 years 2 weeks ago by kallay	Replies:1 Views:2567	Last Post by kallay 6 years 2 weeks ago
EOM Calculation Category: General Questions Topic started 6 years 1 month ago, by jturney Last Post 6 years 3 weeks ago by kallay 1 2 3	Replies:13 Views:9699	Last Post by kallay 6 years 3 weeks ago
Printing amplitudes when mrcc is interfaced Category: General Questions Topic started 6 years 4 months ago, by SBehnle Last Post 6 years 4 months ago by SBehnle	Replies:2 Views:2872	Last Post by SBehnle 6 years 4 months ago
Saving natural orbitals into MOLDEN Category: General Questions Topic started 6 years 4 months ago, by sobereva Last Post 6 years 4 months ago by sobereva	Replies:2 Views:2902	Last Post by sobereva 6 years 4 months ago
arbitrary order Moller-Plesset calculations Category: General Questions Topic started 6 years 5 months ago, by szsmiga Last Post 6 years 5 months ago by kallay	Replies:1 Views:2534	Last Post by kallay 6 years 5 months ago
Low lying excited states Category: General Questions Topic started 6 years 5 months ago, by mongepm Last Post 6 years 5 months ago by kallay	Replies:1 Views:2736	Last Post by kallay 6 years 5 months ago
Some general doubts Category: General Questions Topic started 6 years 6 months ago, by jluiscasalssainz Last Post 6 years 5 months ago by kallay 1 2	Replies:10 Views:7510	Last Post by kallay 6 years 5 months ago
Open shell LCC in the future? Category: General Questions Topic started 6 years 8 months ago, by bkwx97 Last Post 6 years 8 months ago by kallay	Replies:1 Views:2605	Last Post by kallay 6 years 8 months ago
printing basis sets Category: General Questions Topic started 6 years 9 months ago, by koput Last Post 6 years 9 months ago by koput	Replies:2 Views:2728	Last Post by koput 6 years 9 months ago
Interchanging keywords between interfaced programs Category: General Questions Topic started 7 years 1 month ago, by Nike Last Post 6 years 11 months ago by Nike 1 2	Replies:6 Views:7222	Last Post by Nike 6 years 11 months ago
Calculate Element 118 (Uuo/Og) with MRCC Category: General Questions Topic started 7 years 3 weeks ago, by pjerabek Last Post 7 years 3 weeks ago by pjerabek	Replies:3 Views:3523	Last Post by pjerabek 7 years 3 weeks ago
Non-relativistic calculation with DIRAC interface Category: General Questions Topic started 7 years 4 weeks ago, by pjerabek Last Post 7 years 4 weeks ago by pjerabek	Replies:2 Views:2876	Last Post by pjerabek 7 years 4 weeks ago
CC calculations on A1Pi state of AlH Category: General Questions Topic started 7 years 2 months ago, by Ben_Shires Last Post 7 years 2 months ago by kallay	Replies:3 Views:3234	Last Post by kallay 7 years 2 months ago
Symm for states of EOM-CCSD using RECP from DIRAC Category: General Questions Topic started 7 years 4 months ago, by wangf Last Post 7 years 4 months ago by wangf	Replies:0 Views:2793	Last Post by wangf 7 years 4 months ago
Symmetry In the DIRAC interface to MRCC Category: General Questions Topic started 7 years 7 months ago, by wangf Last Post 7 years 6 months ago by kallay 1 2	Replies:10 Views:7330	Last Post by kallay 7 years 6 months ago
D2h symmetry discrepancy between MRCC and DIRAC Category: General Questions Topic started 7 years 7 months ago, by lixpas Last Post 7 years 7 months ago by lixpas	Replies:2 Views:2842	Last Post by lixpas 7 years 7 months ago
Symmetry of a transition density matrix Category: General Questions Topic started 8 years 1 month ago, by leos Last Post 7 years 7 months ago by leos	Replies:5 Views:4186	Last Post by leos 7 years 7 months ago

Time to create page: 0.019 seconds

General Questions 123 topics

MRCC Login