mirror of https://github.com/abinit/abinit.git
1453 lines
96 KiB
Plaintext
1453 lines
96 KiB
Plaintext
F standard fhi98 ini: Troullier-Martins scheme, llocal= 2
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9.00000 7.00000 20201102 zatom,zion,pspdat
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6 7 2 2 477 0.00000 pspcod,pspxc,lmax,llocal,mmax,r2well
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0.00000000000000 0.00000000000000 0.00000000000000 rchrg,fchrg,qchrg
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5--- These two lines are available for giving more information, later
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6
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7--- Here follows the equivalent of the cpi file from the fhi98pp code
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0.70000000000000E+01 3
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0.0000 0.0000 0.0000 0.0000
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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0.0000 .00e+00 .00e+00
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477 0.10247000000000E+01
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