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scissor_operator [2011/12/05 10:10] prokop created |
scissor_operator [2011/12/05 10:11] prokop |
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sigmatol = 0.000001 | sigmatol = 0.000001 | ||
max_scf_iterations = 100 | max_scf_iterations = 100 | ||
- | dt = 0.5 | ||
iqout = 0 | iqout = 0 | ||
- | ismeagol=0 | ||
ifixcharge = 0 | ifixcharge = 0 | ||
&END | &END | ||
Line 27: | Line 25: | ||
&OUTPUT | &OUTPUT | ||
iwrtcdcoefs = 1 | iwrtcdcoefs = 1 | ||
- | iwrtHSrho = 0 | ||
- | iwrteigen = 0 | ||
- | iwrtdos = 0 | ||
&END | &END | ||
</code> | </code> | ||