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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-27 13:53:29 +01:00
qp2/data/basis/cc-pv8z
2019-01-25 11:39:31 +01:00

205 lines
6.2 KiB
Plaintext

HYDROGEN
S 8
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2 3471.4300000 0.00000544
3 1903.1800000 0.00001785
4 623.2860000 0.00007195
5 290.3600000 0.00012055
6 126.5850000 0.00052527
7 44.6955000 0.00201384
8 16.0038000 0.00687086
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S 1
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P 1
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P 1
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P 1
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P 1
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D 1
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I 1
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I 1
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K 1
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NEON
S 13
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3 279049.0000000 0.00001409
4 80647.0000000 0.00005802
5 26764.9000000 0.00020791
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8 1606.5300000 0.00555536
9 703.3980000 0.01455391
10 318.6440000 0.03600119
11 148.2690000 0.08216342
12 70.6164000 0.16533764
13 34.3637000 0.27216031
S 13
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8 1606.5300000 -0.00131201
9 703.3980000 -0.00346487
10 318.6440000 -0.00870414
11 148.2690000 -0.02053558
12 70.6164000 -0.04403733
13 34.3637000 -0.08245730
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S 1
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S 1
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S 1
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S 1
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S 1
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4 164.3140000 0.00150898
5 70.0782000 0.00551808
6 32.0242000 0.01705910
7 15.2906000 0.04560384
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P 1
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P 1
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P 1
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P 1
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P 1
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P 1
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D 1
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D 1
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D 1
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D 1
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D 1
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D 1
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F 1
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F 1
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F 1
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F 1
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F 1
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G 1
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G 1
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G 1
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G 1
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G 1
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H 1
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H 1
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H 1
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H 1
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I 1
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I 1
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I 1
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K 1
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K 1
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L 1
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