This program package calcluates virtually exact solution of the Hartree-Fock and Hartree-Fock-Salter equations for diatomic molecules (distributed under GPL).
11 lines
264 B
Text
11 lines
264 B
Text
--- bin/xhf.org Thu Jul 24 18:25:05 2003
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+++ bin/xhf Thu Jul 24 18:26:38 2003
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@@ -99,7 +99,7 @@
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endif
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echo ' '
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# envoke x2dhf program
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- nice +19 ./x2dhf < $1.data
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+ nice +19 %%PREFIX%%/bin/x2dhf < $1.data
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endif
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if ( $1 != 'remove' ) then
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