General Questions 139 topics

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

Subject	Replies / Views	Last Post
B97M-V in MRCC shows problem (No NL VV10 correction?) Category: General Questions Topic started 7 years 4 months ago, by houqq Last Post 7 years 4 months ago by kallay	Replies:1 Views:3659	Last Post by kallay 7 years 4 months ago
DFT rgrid setup Options (Gauss–Chebyshev quadrature) in MRCC manual has a typo? Category: General Questions Topic started 7 years 4 months ago, by houqq Last Post 7 years 4 months ago by kallay	Replies:1 Views:3376	Last Post by kallay 7 years 4 months ago
An Efficient Hartree–Fock Implementation Category: General Questions Topic started 7 years 6 months ago, by houqq Last Post 7 years 6 months ago by houqq	Replies:0 Views:5420	Last Post by houqq 7 years 6 months ago
Orbitals from Molpro for standalone MRCC Category: General Questions Topic started 7 years 9 months ago, by negoty Last Post 7 years 6 months ago by nagypeter	Replies:3 Views:4643	Last Post by nagypeter 7 years 6 months ago
Can only read custom built fort.55 if scftype=RHF Category: General Questions Topic started 7 years 8 months ago, by Nike Last Post 7 years 8 months ago by Nike	Replies:2 Views:3726	Last Post by Nike 7 years 8 months ago
ADC(2) NTOs Category: General Questions Topic started 7 years 8 months ago, by phillipseeber Last Post 7 years 8 months ago by mesterdavid	Replies:3 Views:4156	Last Post by mesterdavid 7 years 8 months ago
Density from DF- and Local correlation methods Category: General Questions Topic started 7 years 9 months ago, by WanJ Last Post 7 years 9 months ago by WanJ	Replies:2 Views:3756	Last Post by WanJ 7 years 9 months ago
CCSD(T) triples crash Category: General Questions Topic started 7 years 9 months ago, by negoty Last Post 7 years 9 months ago by negoty	Replies:2 Views:3865	Last Post by negoty 7 years 9 months ago
Choice of reference determinant Category: General Questions Topic started 7 years 9 months ago, by negoty Last Post 7 years 9 months ago by kallay	Replies:1 Views:3588	Last Post by kallay 7 years 9 months ago
CCSD convergence Category: General Questions Topic started 7 years 10 months ago, by negoty Last Post 7 years 9 months ago by negoty 1 2	Replies:7 Views:10.7k	Last Post by negoty 7 years 9 months ago
About VV10NL in the MRCC Category: General Questions Topic started 7 years 10 months ago, by Feng Yu Last Post 7 years 10 months ago by kallay	Replies:1 Views:3754	Last Post by kallay 7 years 10 months ago
Problem with standalone MRCC for big basis sets Category: General Questions Topic started 8 years 1 month ago, by Nike Last Post 8 years 1 month ago by kallay	Replies:1 Views:3857	Last Post by kallay 8 years 1 month ago
HF solution of Cr2 Category: General Questions Topic started 8 years 1 month ago, by graceus Last Post 8 years 1 month ago by kallay	Replies:1 Views:3786	Last Post by kallay 8 years 1 month ago
Keywords ignored! Category: General Questions Topic started 8 years 9 months ago, by Nike Last Post 8 years 2 months ago by kallay 1 2 3	Replies:17 Views:18.8k	Last Post by kallay 8 years 2 months ago
intramolecular fragment energy analysis Category: General Questions Topic started 8 years 2 months ago, by sharley Last Post 8 years 2 months ago by nagypeter	Replies:1 Views:3735	Last Post by nagypeter 8 years 2 months ago
CCSDT calling EOM? Category: General Questions Topic started 8 years 5 months ago, by bkwx97 Last Post 8 years 2 months ago by kallay 1 2	Replies:7 Views:11k	Last Post by kallay 8 years 2 months ago
Contents of the fort.* files Category: General Questions Topic started 8 years 3 months ago, by Nike Last Post 8 years 3 months ago by kallay	Replies:3 Views:5059	Last Post by kallay 8 years 3 months ago
Error reading DOMAIN in ovirt Category: General Questions Topic started 8 years 4 months ago, by embcp-19 Last Post 8 years 4 months ago by embcp-19 1 2	Replies:6 Views:10.1k	Last Post by embcp-19 8 years 4 months ago
Columbus Interface Category: General Questions Topic started 8 years 4 months ago, by rayxalapa Last Post 8 years 4 months ago by rayxalapa	Replies:0 Views:5975	Last Post by rayxalapa 8 years 4 months ago
analytic gradients for LMP2 Category: General Questions Topic started 8 years 4 months ago, by sharley Last Post 8 years 4 months ago by kallay	Replies:1 Views:4114	Last Post by kallay 8 years 4 months ago

Time to create page: 0.020 seconds

General Questions 139 topics

MRCC Login