PTEROSOR/QuAcK
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QuAcK/input/basis

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experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 6
RPAx
2020-01-28 09:00:11 +01:00
S 3
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 33.8700000 0.0060680
2 5.0950000 0.0453080
3 1.1590000 0.2028220
clean up
2020-01-17 13:45:02 +01:00
S 1
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 0.3258000 1.0000000
S 1
1 0.1027000 1.0000000
P 1
1 1.4070000 1.0000000
clean up
2020-01-17 13:45:02 +01:00
P 1
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 0.3880000 1.0000000
D 1
1 1.0570000 1.0000000
2 6
QP solutions
2020-02-12 12:25:24 +01:00
S 3
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 33.8700000 0.0060680
2 5.0950000 0.0453080
3 1.1590000 0.2028220
clean up
2020-01-17 13:45:02 +01:00
S 1
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 0.3258000 1.0000000
S 1
1 0.1027000 1.0000000
P 1
1 1.4070000 1.0000000
RPAx
2020-01-28 09:00:11 +01:00
P 1
experimenting with QP_roots
2020-02-12 21:44:35 +01:00
1 0.3880000 1.0000000
D 1
1 1.0570000 1.0000000
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