Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Debichem Team
Revision Date: 2013-08-07 22:48:32 UTC

[ Michael Banck ]
* debian/patches/11_testsuite.patch: New patch, adds CCSD(T)/CASSCF
  geometry optimizations with analytical gradients and CC2/EOM-CCSD/MRCC
  energies to quicktests. Further, do not exit immediately if one test
  fails.
* debian/patches/12_613088_fix_manpage.patch: New patch, removes the
  mangling of the main psi3 manpage with macros (closes: #613088).
* debian/upstream: Removed WIREs article for now as it is specfic to PSI4.
* debian/rules (override_dh_auto_test): Only run testsuite if
  DEB_BUILD_OPTIONS does not contain `nocheck', as per policy.
* debian/psirc.example: New file, contains an example ~/.psirc.
* debian/rules (override_dh_auto_install): Install it.

[ Daniel Leidert ]
* debian/compat: Increased level to 7.
* debian/control (Uploaders): Removed myself.
  (Standards-Version): Bumped to 3.9.4.
  (Build-Depends): Added required version for autotools-dev addon. Replaced
  bison by byacc (closes: #713570).
  (Vcs-Browser, Vcs-Svn): Fixed vcs-field-not-canonical.
  (DM-Upload-Allowed): Dropped.
* debian/dirs: Renamed to debian/psi3.dirs.
* debian/docs: Renamed to debian/psi3.docs. Added user manual.
* debian/psi3.doc-base: Added.
* debian/rules: Use variables instead of commands (e.g. MAKE, RM). Call
  the autotools_dev addon.
  (override_dh_auto_test): Removed the nofilter check. dh will do this.
* debian/upstream: Added.
* debian/README.source: Dropped obsolete file.
* debian/TODO: Dropped.
* debian/patches/*.patch: Added header tags.
* debian/patches/13_parallel-make.patch: Added.
  - Try to improve the compilation process of flex/byacc related stuff.
* debian/patches/14_fix_typos.patch: Added.
  - Fix spelling errors.
* debian/patches/series: Adjusted.

Author: Michael Banck
Revision Date: 2012-03-29 01:26:55 UTC

* debian/control: Add CC3, MRCCSD and SCS-MP2 energies, RHF hessian and
  closed-shell MP2 gradient to features, clarify that MP2-R12 is an
  explicitly correlated method.
* debian/patches/09_system_libint.dpatch: New patch, modifies the build
  system to use the system libint and not compile and link in the shipped
  libint codes.
* debian/control (Build-Depends): Added libint-dev.
* debian/rules (DEB_MAKE_CHECK_TARGET): Run quicktests target to invoke the
  test suite.
* debian/rules: Rewritten for dh.
* debian/control (Build-Depends): Bumped debhelper version to 8, removed
  cdbs and dpatch.
* debian/patches: Moved to source version 3.0 (quilt).
* debian/source/format: New file.
* debian/rules (override_dh_auto_install): Install some test suite input
  files as examples.
* debian/dirs: Added examples directory.
* debian/TODO: Updated.
* debian/control (Standards-Version): Bumped to 3.9.3.
* debian/rules (override_dh_auto_test): Do not abort build on test suite
  failure.
* debian/rules (override_dh_auto_build): New rule, build the user manual in
  addition to the main code.
* debian/control (Build-Depends): Added texlive-latex-recommended.
* debian/patches/10_makerules_doc.patch: New patch, build the postscript
  file by default and deletes some more generated files on realclean.
* debian/rules (override_dh_auto_install): Install postscript user manual
  into documentation directory.

Author: Michael Banck
Revision Date: 2012-03-29 01:26:55 UTC

* debian/control: Add CC3, MRCCSD and SCS-MP2 energies, RHF hessian and
  closed-shell MP2 gradient to features, clarify that MP2-R12 is an
  explicitly correlated method.
* debian/patches/09_system_libint.dpatch: New patch, modifies the build
  system to use the system libint and not compile and link in the shipped
  libint codes.
* debian/control (Build-Depends): Added libint-dev.
* debian/rules (DEB_MAKE_CHECK_TARGET): Run quicktests target to invoke the
  test suite.
* debian/rules: Rewritten for dh.
* debian/control (Build-Depends): Bumped debhelper version to 8, removed
  cdbs and dpatch.
* debian/patches: Moved to source version 3.0 (quilt).
* debian/source/format: New file.
* debian/rules (override_dh_auto_install): Install some test suite input
  files as examples.
* debian/dirs: Added examples directory.
* debian/TODO: Updated.
* debian/control (Standards-Version): Bumped to 3.9.3.
* debian/rules (override_dh_auto_test): Do not abort build on test suite
  failure.
* debian/rules (override_dh_auto_build): New rule, build the user manual in
  addition to the main code.
* debian/control (Build-Depends): Added texlive-latex-recommended.
* debian/patches/10_makerules_doc.patch: New patch, build the postscript
  file by default and deletes some more generated files on realclean.
* debian/rules (override_dh_auto_install): Install postscript user manual
  into documentation directory.

Author: Matthias Klose
Revision Date: 2011-09-11 11:22:02 UTC

gfortran-4.6 rebuild.

Author: Matthias Klose
Revision Date: 2011-09-11 11:22:02 UTC

gfortran-4.6 rebuild.

Author: Daniel Leidert
Revision Date: 2009-08-29 15:24:28 UTC

* debian/control (Standards-Version): Bumped to 3.8.3.
  (Build-Depends): Added autotools-dev to fix
  outdated-autotools-helper-file lintian warning.
  (Vcs-Svn): Fixed vcs-field-uses-not-recommended-uri-format.
* debian/rules (install/psi3): Remove all manual pages except the one for
  the psi3 executable.
* debian/README.source: Added to make lintian happy.
* debian/patches/08_525758_ftbfs_with_gcc44.dpatch: Added.
  - Fix FTBFS with GCC 4.4 (closes: #525758).
* debian/patches/00list: Adjusted.

Author: Daniel Leidert
Revision Date: 2009-08-29 15:24:28 UTC

* debian/control (Standards-Version): Bumped to 3.8.3.
  (Build-Depends): Added autotools-dev to fix
  outdated-autotools-helper-file lintian warning.
  (Vcs-Svn): Fixed vcs-field-uses-not-recommended-uri-format.
* debian/rules (install/psi3): Remove all manual pages except the one for
  the psi3 executable.
* debian/README.source: Added to make lintian happy.
* debian/patches/08_525758_ftbfs_with_gcc44.dpatch: Added.
  - Fix FTBFS with GCC 4.4 (closes: #525758).
* debian/patches/00list: Adjusted.

Author: Daniel Leidert
Revision Date: 2009-08-29 15:24:28 UTC

* debian/control (Standards-Version): Bumped to 3.8.3.
  (Build-Depends): Added autotools-dev to fix
  outdated-autotools-helper-file lintian warning.
  (Vcs-Svn): Fixed vcs-field-uses-not-recommended-uri-format.
* debian/rules (install/psi3): Remove all manual pages except the one for
  the psi3 executable.
* debian/README.source: Added to make lintian happy.
* debian/patches/08_525758_ftbfs_with_gcc44.dpatch: Added.
  - Fix FTBFS with GCC 4.4 (closes: #525758).
* debian/patches/00list: Adjusted.

Author: Michael Banck
Revision Date: 2008-07-27 13:16:17 UTC

* debian/control: Improved description.
* debian/control (Standards-Version): Bumped to 3.8.0.1.

Author: Michael Banck
Revision Date: 2008-06-07 16:49:57 UTC

* 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.

Author: Daniel Leidert
Revision Date: 2008-03-11 02:24:33 UTC

[ Daniel Leidert ]
* debian/compat: Raised to level 5.
* debian/control: Added DM-Upload-Allowed for DM status.
  (Uploaders): Added myself.
  (Build-Depends): Raised to debhelper v5.
  (Standards-Version): Updated to latest policy (no other changes).
* debian/copyright: Updated.
* debian/rules: Added DEB_MAKE_CLEAN_TARGET variable with adjusted value and
  a clean target to remove created stuff (not perfect, but closes: #442704).
  Further make sure that we do not build outside our source directory via
  DEB_MAKE_ENVVARS. Added noopt-handling. Further set -Wall -g.
* debian/patches/04_man.dpatch: Small fix to comply to common rules.
* debian/patches/06_466828_fix_gcc_43_ftbfs.dpatch: Added.
  - Fixes several issues with GCC 4.3 (closes: #466828) and some compiler
    warnings.
* debian/patches/00list: Adjusted.

[ Michael Banck ]
* debian/rules (DEB_MAKE_CHECK_TARGET): Ignore test suite failures.
* debian/patches/05_disable_mp2_tests.dpatch: Removed, no longer needed.
* debian/patches/00list: Adjusted.

Author: Matthias Klose
Revision Date: 2007-03-01 22:52:50 UTC

* Rebuild for ldbl128 change (powerpc, sparc).
* Set Ubuntu maintainer address.

Author: Matthias Klose
Revision Date: 2007-03-01 22:52:50 UTC

* Rebuild for ldbl128 change (powerpc, sparc).
* Set Ubuntu maintainer address.

Author: Michael Banck
Revision Date: 2006-09-10 14:01:33 UTC

Initial upload.

Author: Andres Rodriguez
Revision Date: 2009-06-18 23:50:23 UTC

* debian/patches/08_missing_libraries.dpatch:
  - Included missing libraries in several files. Fixes FTBFS. (LP: #389305)