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Viewing changes to src/lib/libchkpt/ecorr.c

  • Committer: Bazaar Package Importer
  • Author(s): Michael Banck
  • Date: 2008-06-07 16:49:57 UTC
  • mfrom: (2.1.2 hardy)
  • Revision ID: james.westby@ubuntu.com-20080607164957-8pifvb133yjlkagn
Tags: 3.3.0-3
http://bugs.debian.org/464867
* debian/rules (DEB_MAKE_CHECK_TARGET): Do not abort test suite on
  failures.
* debian/rules (DEB_CONFIGURE_EXTRA_FLAGS): Set ${bindir} to /usr/lib/psi.
* debian/rules (install/psi3): Move psi3 file to /usr/bin.
* debian/patches/07_464867_move_executables.dpatch: New patch, add
  /usr/lib/psi to the $PATH, so that the moved executables are found.
  (closes: #464867)
* debian/patches/00list: Adjusted.

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src/lib/libchkpt/ecorr.c
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*/
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#include <stdio.h>
 
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#include <stdlib.h>
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#include "chkpt.h"
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#include <psifiles.h>
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#include <libciomr/libciomr.h>
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double chkpt_rd_ecorr(void)
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{
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  double ecorr;
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  psio_read_entry(PSIF_CHKPT, "::Correlation energy", (char *) &ecorr,
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                  sizeof(double));
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  char *keyword;
 
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  keyword = chkpt_build_keyword("Correlation energy");
 
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  psio_read_entry(PSIF_CHKPT, keyword, (char *) &ecorr,
 
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    sizeof(double));
 
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  free(keyword);
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  return ecorr;
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}
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*/
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void chkpt_wt_ecorr(double ecorr)
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{
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  psio_write_entry(PSIF_CHKPT, "::Correlation energy", (char *) &ecorr,
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                   sizeof(double));
 
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  char *keyword;
 
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  keyword = chkpt_build_keyword("Correlation energy");
 
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  psio_write_entry(PSIF_CHKPT, keyword, (char *) &ecorr,
 
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    sizeof(double));
 
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  free(keyword);
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}
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