mirror of https://github.com/phonopy/phonopy.git
52 lines
1.2 KiB
Plaintext
52 lines
1.2 KiB
Plaintext
$jbas
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*
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si universal
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# si (14s5p5d2f1g) / [8s4p3d1f1g] {71111111/2111/311/2/1}
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*
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7 s
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5826.7657660 0.56779830000
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2173.1214409 1.0118069000
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839.49665090 3.2799844000
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335.26596220 6.7361713000
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138.11709780 8.6949143000
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58.551605400 3.2431556000
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25.474427400 -1.2520738000
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1 s
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11.341841500 2.6706099000
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1 s
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5.1513356000 4.3474757000
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1 s
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2.3788654000 0.87290070000
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1 s
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1.1130498000 -0.32446030000
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1 s
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0.52574270000 0.29569790000
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1 s
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0.24975780000 0.19468850000
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1 s
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0.11887680000 0.31863200000E-01
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2 p
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8.7836931000 0.24224500000E-01
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2.6158248000 -0.15326800000E-01
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1 p
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0.82660400000 0.61588000000E-02
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1 p
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0.27114870000 0.42806600000E-01
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1 p
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0.90087000000E-01 0.15544000000E-02
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3 d
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10.889276700 0.24059300000E-01
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2.6605925000 -0.18990400000E-01
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0.80675280000 0.24210800000E-01
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1 d
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0.28598480000 0.31714700000E-01
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1 d
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0.10743290000 0.20599000000E-02
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2 f
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0.81038160000 0.88216000000E-02
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0.19885290000 0.20248000000E-02
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1 g
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0.40149000000 -0.16684000000E-02
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*
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$end
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