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Viewing changes to src/lib/libdpd/trans4_mat_irrep_close.c

  • Committer: Bazaar Package Importer
  • Author(s): Michael Banck, Michael Banck, Daniel Leidert
  • Date: 2009-02-23 00:12:02 UTC
  • mfrom: (1.1.2 upstream)
  • Revision ID: james.westby@ubuntu.com-20090223001202-rutldoy3dimfpesc
Tags: 3.4.0-1
* New upstream release.

[ Michael Banck ]
* debian/patches/01_DESTDIR.dpatch: Refreshed.
* debian/patches/02_FHS.dpatch: Removed, applied upstream.
* debian/patches/03_debian_docdir: Likewise.
* debian/patches/04_man.dpatch: Likewise.
* debian/patches/06_466828_fix_gcc_43_ftbfs.dpatch: Likewise.
* debian/patches/07_464867_move_executables: Fixed and refreshed.
* debian/patches/00list: Adjusted.
* debian/control: Improved description.
* debian/patches-held: Removed.
* debian/rules (install/psi3): Do not ship the ruby bindings for now.

[ Daniel Leidert ]
* debian/rules: Fix txtdir via DEB_MAKE_INSTALL_TARGET.
* debian/patches/01_DESTDIR.dpatch: Refreshed.

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Lines of Context:
src/lib/libdpd/trans4_mat_irrep_close.c
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#include <stdio.h>
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#include <stdlib.h>
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#include <libciomr/libciomr.h>
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#include "dpd.h"
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#define EXTERN
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#include "dpd.gbl"
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int dpd_trans4_mat_irrep_close(dpdtrans4 *Trans, int irrep)
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{
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  int h, nirreps, rowtot, coltot, all_buf_irrep;
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  long int size;
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  all_buf_irrep = Trans->buf.file.my_irrep;
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  nirreps = Trans->buf.params->nirreps;
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  rowtot = Trans->buf.params->coltot[irrep^all_buf_irrep];
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  coltot = Trans->buf.params->rowtot[irrep];
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  size = ((long) rowtot) * ((long) coltot);
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  /* Free the shift structure for this irrep if used */
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  if(Trans->shift.shift_type) {
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      for(h=0; h < nirreps; h++)
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          if(Trans->shift.rowtot[irrep][h])
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              free(Trans->shift.matrix[irrep][h]);
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      free(Trans->shift.matrix[irrep]);
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      Trans->shift.shift_type = 0;
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    }
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  if(size)
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      dpd_free_block(Trans->matrix[irrep], rowtot, coltot);
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  return 0;
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}