mirror of https://github.com/TREX-CoE/qmckl.git
71 lines
996 B
Plaintext
71 lines
996 B
Plaintext
rank_ao_shell 1
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dims_ao_shell 0 30
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rank_ao_normalization 1
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dims_ao_normalization 0 30
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ao_cartesian_isSet 1
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ao_cartesian 1
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ao_num_isSet 1
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ao_num 30
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ao_shell
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0
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1
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2
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3
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3
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3
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4
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4
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4
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5
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5
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5
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5
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6
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9
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10
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10
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11
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11
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11
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11
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11
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11
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ao_normalization
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000002e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.7320508075688772e+00
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1.7320508075688767e+00
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9.9999999999999978e-01
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1.7320508075688772e+00
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9.9999999999999978e-01
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.0000000000000002e+00
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1.0000000000000000e+00
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1.0000000000000000e+00
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1.7320508075688776e+00
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1.7320508075688772e+00
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1.0000000000000000e+00
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1.7320508075688776e+00
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1.0000000000000000e+00
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