Sandbox::https://github.com/cclib/cclib/tree/master/data

Visitar URL original

cclib/data at master · cclib/cclib · GitHub

Repository navigation

Name		Name	Last commit message	Last commit date
parent directory ..
ADF		ADF
CFOUR/basicCFOUR2.1		CFOUR/basicCFOUR2.1
DALTON		DALTON
FChk		FChk
GAMESS-UK		GAMESS-UK
GAMESS		GAMESS
GAMESSDAT/basicGAMESS-US2018		GAMESSDAT/basicGAMESS-US2018
Gaussian		Gaussian
Jaguar		Jaguar
MOPAC		MOPAC
Molcas/basicOpenMolcas18.0		Molcas/basicOpenMolcas18.0
Molpro		Molpro
NBO/basicNBO7.0/basicORCA5.0		NBO/basicNBO7.0/basicORCA5.0
NWChem		NWChem
ORCA		ORCA
Psi4		Psi4
PySCF/basicPySCF2.6		PySCF/basicPySCF2.6
QChem		QChem
Serenity		Serenity
Turbomole		Turbomole
XTB		XTB
.gitignore		.gitignore
regression_download.sh		regression_download.sh