(857) Search Results

From NWChem

Displaying 25 results for: Edoapra Posts
Jump to: navigation, search

Thread Title Replies Views Last Action Forum
esp: bas_rtdb_load failed
Started By : Nwchem scl6
1 55 Nov 21st 9:57 am
Edoapra
General Topics
lmpiblacs problems while compiling on Centos HPC
Started By : Bradjac2
6 174 Nov 6th 8:30 am
Bradjac2
Compiling NWChem
Meaning of nbf_ao .ne. nmo output during CDFT run?
Started By : Jdhoward
1 174 Nov 5th 10:54 am
Edoapra
General Topics
NWChem error
Started By : Koeu
1 74 Nov 5th 10:15 am
Edoapra
Compiling NWChem
Compiling NWCHEM on Ubuntu 12.04.2 LTS (not as administrator)1 2
Started By : John1234
20 665 Oct 28th 6:29 pm
John1234
Compiling NWChem
Size of Cube file
Started By : P99
1 127 Oct 28th 9:44 am
Edoapra
Running NWChem
scf: no. of closed-shell elecrons is not even
Started By : Loganr
1 138 Oct 23rd 9:02 am
Edoapra
Running NWChem
'noautoz'
Started By : Tatireddy
4 2510 Oct 22nd 8:57 am
Edoapra
Running NWChem
Compiling 6.8.1 on CentOS Cluster with OpenMPI
Started By : StanfordFry
1 160 Oct 8th 8:13 am
Edoapra
Compiling NWChem
fon with rodft
Started By : G123
1 245 Sep 23rd 8:48 am
Edoapra
General Topics
Error in DPlot: VIEW and nOrb > 1 conflict
Started By : Marcel
1 295 Sep 9th 12:38 pm
Edoapra
Running NWChem
SCF residual greater than 1d-2 error for Raman calculation
Started By : IGClayson
3 183 Aug 29th 9:01 am
Edoapra
Running NWChem
error load output with gabedit 2.5.0 nwchem 6.8
Started By : Marcel
5 281 Aug 27th 8:24 am
Edoapra
Running NWChem
I/O error for NWCHEM
Started By : Garfield
1 163 Aug 21st 3:28 pm
Edoapra
Running NWChem
Local ECP potential is zero and ignored
Started By : Gncs
4 1100 Aug 21st 8:17 am
Edoapra
Running NWChem
Problems with negative frequencies
Started By : Sophia.sagala
4 645 Aug 19th 2:07 pm
Edoapra
Running NWChem
cphf_solve2 issues for vibrational calculation in version 6.8.1
Started By : IGClayson
3 227 Aug 19th 8:47 am
IGClayson
Running NWChem
Problem in import calc from NWChem/ECCE output file
Started By : Niu
6 4413846 Aug 7th 10:35 am
Edoapra
General ECCE Topics
ioctl error when using nwchem with ase
Started By : Betacentauri
1 204 Aug 5th 11:05 am
Edoapra
Running NWChem
Memory Error
Started By : Gpareras
3 176 Aug 2nd 8:15 am
Edoapra
Running NWChem
Description of geometry in output file
Started By : Sergbuto
1 157 Jul 31st 9:29 am
Edoapra
Running NWChem
SCAN meta-GGA functional
Started By : Bsantra
5 1233 Jul 22nd 10:58 am
Edoapra
NWChem functionality
v6.8.1 error in ddot intel compiler
Started By : Bsantra
3 491 Jul 18th 8:39 am
Edoapra
Compiling NWChem
Question about "actlist"and "fix atom"
Started By : Hong420
1 218 Jul 16th 8:17 am
Edoapra
General Topics
6.8 on Windows
Started By : P99
3 1290 Jul 12th 9:58 am
Edoapra
Compiling NWChem
Jump to page 12345678Next 25Last

Who's here now Members 0 Guests 0 Bots/Crawler 0


AWC's: 2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC