srDFT_G2/G09/Large_core/Molecules/avqz
2019-04-04 11:10:45 +02:00
..
BeH.xyz data 2019-04-04 11:10:45 +02:00
C2H2.xyz data 2019-04-04 11:10:45 +02:00
C2H4.xyz data 2019-04-04 11:10:45 +02:00
C2H6.xyz data 2019-04-04 11:10:45 +02:00
ccsdt_fc_avqz.template data 2019-04-04 11:10:45 +02:00
CH2_1A1.xyz data 2019-04-04 11:10:45 +02:00
CH2_3B1.xyz data 2019-04-04 11:10:45 +02:00
CH3.xyz data 2019-04-04 11:10:45 +02:00
CH3Cl.xyz data 2019-04-04 11:10:45 +02:00
CH3SH.xyz data 2019-04-04 11:10:45 +02:00
CH4.xyz data 2019-04-04 11:10:45 +02:00
CH4O.xyz data 2019-04-04 11:10:45 +02:00
CH.xyz data 2019-04-04 11:10:45 +02:00
Cl2.xyz data 2019-04-04 11:10:45 +02:00
ClF.xyz data 2019-04-04 11:10:45 +02:00
ClO.xyz data 2019-04-04 11:10:45 +02:00
CN.xyz data 2019-04-04 11:10:45 +02:00
CO2.xyz data 2019-04-04 11:10:45 +02:00
CO.xyz data 2019-04-04 11:10:45 +02:00
create_ezfio.sh data 2019-04-04 11:10:45 +02:00
create_input.sh data 2019-04-04 11:10:45 +02:00
CS.xyz data 2019-04-04 11:10:45 +02:00
F2.xyz data 2019-04-04 11:10:45 +02:00
H2CO.xyz data 2019-04-04 11:10:45 +02:00
H2O2.xyz data 2019-04-04 11:10:45 +02:00
H2O.xyz data 2019-04-04 11:10:45 +02:00
H2S.xyz data 2019-04-04 11:10:45 +02:00
H3COH.xyz data 2019-04-04 11:10:45 +02:00
H3CSH.xyz data 2019-04-04 11:10:45 +02:00
HCl.xyz data 2019-04-04 11:10:45 +02:00
HCN.xyz data 2019-04-04 11:10:45 +02:00
HCO.xyz data 2019-04-04 11:10:45 +02:00
HF.xyz data 2019-04-04 11:10:45 +02:00
HOCl.xyz data 2019-04-04 11:10:45 +02:00
Li2.xyz data 2019-04-04 11:10:45 +02:00
LiF.xyz data 2019-04-04 11:10:45 +02:00
LiH.xyz data 2019-04-04 11:10:45 +02:00
N2.xyz data 2019-04-04 11:10:45 +02:00
N2H4.xyz data 2019-04-04 11:10:45 +02:00
Na2.xyz data 2019-04-04 11:10:45 +02:00
NaCl.xyz data 2019-04-04 11:10:45 +02:00
NH2.xyz data 2019-04-04 11:10:45 +02:00
NH3.xyz data 2019-04-04 11:10:45 +02:00
NH.xyz data 2019-04-04 11:10:45 +02:00
NO.xyz data 2019-04-04 11:10:45 +02:00
O2.xyz data 2019-04-04 11:10:45 +02:00
OH.xyz data 2019-04-04 11:10:45 +02:00
P2.xyz data 2019-04-04 11:10:45 +02:00
PH2.xyz data 2019-04-04 11:10:45 +02:00
PH3.xyz data 2019-04-04 11:10:45 +02:00
run_g09.sh data 2019-04-04 11:10:45 +02:00
S2.xyz data 2019-04-04 11:10:45 +02:00
Si2.xyz data 2019-04-04 11:10:45 +02:00
Si2H6.xyz data 2019-04-04 11:10:45 +02:00
SiH2_1A1.xyz data 2019-04-04 11:10:45 +02:00
SiH2_3B1.xyz data 2019-04-04 11:10:45 +02:00
SiH3.xyz data 2019-04-04 11:10:45 +02:00
SiH4.xyz data 2019-04-04 11:10:45 +02:00
SiO.xyz data 2019-04-04 11:10:45 +02:00
SO2.xyz data 2019-04-04 11:10:45 +02:00
SO.xyz data 2019-04-04 11:10:45 +02:00