General BSE Topics

Announcement's Replies Views Last Action
Locked Sticky: Website shutting down on July 31st 2020. Moving to google groups
0 1715 Jun 18th 5:01 pm
Edoapra
Locked Sticky: NWChem 7.0.0 available for dowload
0 13620 Dec 14th 2:51 pm
Edoapra

Jump to page 1Prev 25
Thread Title Replies Views Last Action
basis set with spherical/Cartesian information
2 3389 Feb 25th 4:47 am
Ahmad.ziaee
def2-QZVP and above
0 2932 Feb 4th 7:07 am
Alexbalboa
Basis Set Database in HDF5 format
0 2443 Nov 4th 9:23 am
Vladimir
Unable to upload basis set
1 2194 Oct 25th 2:22 am
Rosebd
using https://bse.pnl.gov/axis/services/BseService?wsdl
1 3962 Jun 25th 12:41 pm
Mernst
aug-cc-pwcCVTZ basis set for Bromine
6 3526 Jun 10th 4:15 am
DanielaT
Dalton format
3 3462 May 13th 2:16 pm
Huub
ADZP/DZP basis: missing atom and invalid basis data
2 3495 May 9th 2:29 pm
Huub
TZP basis missing data
1 2313 May 5th 3:13 pm
Huub
pcseg-n
5 2997 Apr 25th 11:17 am
Huub
ANO_RCC basis set missing bits
3 2327 Apr 25th 10:27 am
Huub
formatting problem (ACES II/CFOUR)
2 3556 Dec 9th 3:02 pm
Huub
def2 basis sets
3 5924 Nov 25th 12:59 pm
Huub
Apparent error in one d exponent in 6-311G(2df)-type basis sets
1 3949 Nov 18th 4:00 pm
Huub
Problem accessing BSE through WSDL
2 2958 Oct 18th 12:55 am
Makowskm
An error in the ANO-RCC/Sb basis functions
4 3559 Jul 2nd 1:19 pm
Huub
Error in ANO-RCC Mg and Al
5 2771 Jul 1st 2:19 am
Jellby
error in LanL2tz for Hg
1 2786 Mar 25th 12:00 pm
Bert
error in cc-pV(6+d)Z basis set for Sulfur
1 2773 Mar 18th 1:39 pm
Bert
Bug in Gaussian'94 interface
1 2391 Dec 13th 3:07 pm
Jussilehtola
missing diffuse functions in DZP+diffuse basis sets
2 3585 Dec 6th 11:24 am
Bert
Verification of new basis sets
3 2640 Oct 12th 6:34 pm
Bert
Basis Set Library currently offline
2 3905 Aug 27th 2:04 pm
Huub
Stuck after entering reference
1 2883 Jun 7th 4:34 pm
Brett

Forum >> BSE: Basis Set Exchange >> General BSE Topics
Jump to page 1Prev 25