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quantum_package/data/inputs
History
Anthony Scemama de6af26a8b Makefile in data/inputs corrected
2014-04-07 09:21:53 +02:00
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Al.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Al+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
AlCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
AlH2.out.ezfio.md5
Added checked inputs for tests.
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AlH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
AlH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
B.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
B+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Be.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Be+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeF.out.ezfio.md5
Added checked inputs for tests.
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BeH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeOH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BeS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
BO.out.ezfio.md5
Added checked inputs for tests.
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BS.out.ezfio.md5
Added checked inputs for tests.
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C2.out.ezfio.md5
Added checked inputs for tests.
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C2H2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C2H2+.out.ezfio.md5
Added checked inputs for tests.
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C2H3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C2H3+.out.ezfio.md5
Added checked inputs for tests.
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C2H4.out.ezfio.md5
Added checked inputs for tests.
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C2H4+.out.ezfio.md5
Added checked inputs for tests.
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C2H5.out.ezfio.md5
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C2H6.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C2H.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
C+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CF.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH2_1A1.out.ezfio.md5
Added checked inputs for tests.
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CH2_3B1.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH3-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH3.out.ezfio.md5
Added checked inputs for tests.
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CH4.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH4+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl2+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Cl+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
ClH2+.out.ezfio.md5
Added checked inputs for tests.
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ClH.out.ezfio.md5
Added checked inputs for tests.
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ClH+.out.ezfio.md5
Added checked inputs for tests.
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ClS.out.ezfio.md5
Added checked inputs for tests.
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ClSiH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CN-.out.ezfio.md5
Added checked inputs for tests.
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CN.out.ezfio.md5
Added checked inputs for tests.
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CO2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CO+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
COS.out.ezfio.md5
Added checked inputs for tests.
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CP.out.ezfio.md5
Added checked inputs for tests.
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CS2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CS+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
CSi.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
F2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
F-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
F.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
F+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FAl.out.ezfio.md5
Added checked inputs for tests.
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FCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FCl+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FH+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FMg.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FNa.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
FP.out.ezfio.md5
Added checked inputs for tests.
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FS.out.ezfio.md5
Added checked inputs for tests.
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FSi.out.ezfio.md5
Added checked inputs for tests.
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FSiH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H2CNH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H2CO.out.ezfio.md5
Added checked inputs for tests.
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H2CPH.out.ezfio.md5
Added checked inputs for tests.
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H2CS.out.ezfio.md5
Added checked inputs for tests.
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H2NNH2.out.ezfio.md5
Added checked inputs for tests.
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H2PPH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3CCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3CF.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3CNH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3COH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3CSH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H3SiSiH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
H.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HBO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HBS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HCF.out.ezfio.md5
Added checked inputs for tests.
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HCN.out.ezfio.md5
Added checked inputs for tests.
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HCO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HCP.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HNO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HOCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HOF.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HOMg.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HONa.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HOO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HOOH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
HSSH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Li2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Li.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Li+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiF.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiN.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiO.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
LiOH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Makefile
Makefile in data/inputs corrected
2014-04-07 09:21:53 +02:00
Mg.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Mg+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
MgCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
MgH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
MgS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
N2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
N2+.out.ezfio.md5
Added checked inputs for tests.
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N.out.ezfio.md5
Added checked inputs for tests.
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N+.out.ezfio.md5
Added checked inputs for tests.
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Na2.out.ezfio.md5
Added checked inputs for tests.
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Na.out.ezfio.md5
Added checked inputs for tests.
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Na+.out.ezfio.md5
Added checked inputs for tests.
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NaCl.out.ezfio.md5
Added checked inputs for tests.
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NaH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NF.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH2.out.ezfio.md5
Added checked inputs for tests.
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NH3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH3+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH4+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
NH.out.ezfio.md5
Added checked inputs for tests.
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NO-.out.ezfio.md5
Added checked inputs for tests.
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NO.out.ezfio.md5
Added checked inputs for tests.
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NP.out.ezfio.md5
Added checked inputs for tests.
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NS.out.ezfio.md5
Added checked inputs for tests.
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NSi.out.ezfio.md5
Added checked inputs for tests.
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O2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O2+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O2Cl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O2S.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O2Si.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O3.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
O+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OH2+.out.ezfio.md5
Added checked inputs for tests.
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OH3+.out.ezfio.md5
Added checked inputs for tests.
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OH-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OH+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OMg.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
ONa.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OP-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OP.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OPH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
OSi.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
P2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
P2+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
P-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
P.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PH2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PH2+.out.ezfio.md5
Added checked inputs for tests.
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PH3.out.ezfio.md5
Added checked inputs for tests.
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PH3+.out.ezfio.md5
Added checked inputs for tests.
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PH4+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PH-.out.ezfio.md5
Added checked inputs for tests.
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PH.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
PS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
S2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
S2.out.ezfio.md5
Added checked inputs for tests.
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S-.out.ezfio.md5
Added checked inputs for tests.
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S.out.ezfio.md5
Added checked inputs for tests.
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S+.out.ezfio.md5
Added checked inputs for tests.
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SH2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SH2+.out.ezfio.md5
Added checked inputs for tests.
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SH3+.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SH-.out.ezfio.md5
Added checked inputs for tests.
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SH.out.ezfio.md5
Added checked inputs for tests.
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SH+.out.ezfio.md5
Added checked inputs for tests.
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Si2.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Si-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
Si.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SiCl.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SiH2_1A1.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SiH2_3B1.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SiH2-.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00
SiH3-.out.ezfio.md5
Added checked inputs for tests.
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SiH3.out.ezfio.md5
Added checked inputs for tests.
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SiH4.out.ezfio.md5
Added checked inputs for tests.
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SiH4+.out.ezfio.md5
Added checked inputs for tests.
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SiH-.out.ezfio.md5
Added checked inputs for tests.
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SiH.out.ezfio.md5
Added checked inputs for tests.
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SiS.out.ezfio.md5
Added checked inputs for tests.
2014-04-07 00:39:18 +02:00