5 lines
378 B
Plaintext
5 lines
378 B
Plaintext
# CTIP potential parameters for Ni-O
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# X (eV) J (eV) gamma (1/ang) zeta (1/ang) Z (e) qmin qmax omega
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Ni -5.840000 14.157390 0.549290 0.000000 0.000000 0.000000 2.000000 100.000
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O 0.000000 15.655862 1.428571 0.000000 0.000000 -2.000000 0.000000 100.000
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