37 lines
443 B
Plaintext
37 lines
443 B
Plaintext
# atsym z nc nv iexc psfile
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Cs 55 9 3 -001012 psp8
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# n l f
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1 0 2.0
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2 0 2.0
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2 1 6.0
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3 0 2.0
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3 1 6.0
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3 2 10.0
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4 0 2.0
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4 1 6.0
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4 2 10.0
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5 0 2.0
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5 1 6.0
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6 0 1.0
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# lmax
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3
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# l rc ep ncon nbas qcut
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0 2.25 0.0 4 7 4.8
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1 1.85 0.0 4 7 6.0
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2 2.0 0.0 4 8 6.2
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3 2.25 0.05 4 7 2.0
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# lloc lpopt rc5 dvloc0
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4 5 1.85 0.0
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# l nproj debl
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0 2 1.0
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1 2 5.0
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2 2 5.0
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3 2 2.0
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# icmod fcfact rcfact
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3 5.0 1.4
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# epsh1 epsh2 depsh
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-12.0 12.0 0.02
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# rlmax drl
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6.0 0.01
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0
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