srDFT_G2/G09/Small_core/Atoms/cvtz/Be.inp
2019-04-09 14:00:19 +02:00

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#p ROCCSD(T,FreezeInnerNobleGasCore) GEN pop=full gfprint
G2
0,1
Be
Be 0
S 9 1.00
6863.0000000 0.0002360
1030.0000000 0.0018260
234.7000000 0.0094520
66.5600000 0.0379570
21.6900000 0.1199650
7.7340000 0.2821620
2.9160000 0.4274040
1.1300000 0.2662780
0.1101000 -0.0072750
S 9 1.00
6863.0000000 -0.0000430
1030.0000000 -0.0003330
234.7000000 -0.0017360
66.5600000 -0.0070120
21.6900000 -0.0231260
7.7340000 -0.0581380
2.9160000 -0.1145560
1.1300000 -0.1359080
0.1101000 0.5774410
S 1 1.00
0.2577000 1.0000000
S 1 1.00
0.0440900 1.0000000
S 1 1.00
4.6040000 1.0000000
S 1 1.00
1.6170000 1.0000000
P 3 1.00
7.4360000 0.0107360
1.5770000 0.0628540
0.4352000 0.2481800
P 1 1.00
0.1438000 1.0000000
P 1 1.00
0.0499400 1.0000000
P 1 1.00
14.4970000 1.0000000
P 1 1.00
3.7870000 1.0000000
D 1 1.00
0.3480000 1.0000000
D 1 1.00
0.1803000 1.0000000
D 1 1.00
9.1830000 1.0000000
F 1 1.00
0.3250000 1.0000000
****