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

Thread Title	Replies	Views	Last Action
Ni ANO-RCC	4	2009	Sep 17th 12:41 pm PrimeFan
cc-pVXZ basis sets	0	2046	Aug 13th 10:08 am Cmk
6-311G basis set for transition metals	3	3470	Jun 17th 12:20 pm Mernst
Uploading_sets_error	2	29460	May 27th 3:20 am Tteodoro
cc-pCV6Z for 2nd row (Al-Ar) in error	13	1836	Apr 14th 7:59 am Kipeters
misnamed elements in CRENBL ECP basis set	0	2754	Mar 4th 2:42 am Mernst
hydrogen in aug-cc-pCV5Z	0	2177	Mar 4th 2:32 am Mernst
basis set with spherical/Cartesian information	2	3387	Feb 25th 4:47 am Ahmad.ziaee
def2-QZVP and above	0	2930	Feb 4th 7:07 am Alexbalboa
Basis Set Database in HDF5 format	0	2441	Nov 4th 9:23 am Vladimir
Unable to upload basis set	1	2192	Oct 25th 2:22 am Rosebd
using https://bse.pnl.gov/axis/services/BseService?wsdl	1	3960	Jun 25th 12:41 pm Mernst
aug-cc-pwcCVTZ basis set for Bromine	6	3524	Jun 10th 4:15 am DanielaT
Dalton format	3	3460	May 13th 2:16 pm Huub
ADZP/DZP basis: missing atom and invalid basis data	2	3493	May 9th 2:29 pm Huub
TZP basis missing data	1	2311	May 5th 3:13 pm Huub
pcseg-n	5	2995	Apr 25th 11:17 am Huub
ANO_RCC basis set missing bits	3	2325	Apr 25th 10:27 am Huub
formatting problem (ACES II/CFOUR)	2	3554	Dec 9th 3:02 pm Huub
def2 basis sets	3	5922	Nov 25th 12:59 pm Huub
Apparent error in one d exponent in 6-311G(2df)-type basis sets	1	3947	Nov 18th 4:00 pm Huub
Problem accessing BSE through WSDL	2	2956	Oct 18th 12:55 am Makowskm
An error in the ANO-RCC/Sb basis functions	4	3557	Jul 2nd 1:19 pm Huub
Error in ANO-RCC Mg and Al	5	2769	Jul 1st 2:19 am Jellby
error in LanL2tz for Hg	1	2784	Mar 25th 12:00 pm Bert