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Commits on Jun 18, 2016

• install psi4.so to site-packages. fix ambit detection.

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Commits on Jun 4, 2016

• examples in setup for args that might be interpreted as short-name args

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  loriab

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Commits on Mar 28, 2016

• Fixes os.environ error

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  jturney

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Commits on Mar 25, 2016

• Merge branch 'master' into honor-CC

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Commits on Mar 22, 2016

• Added G* formatted checkpoint writer, and initial implementation of Stonee's distributed multipole analysis.

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  andysim

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Commits on Mar 21, 2016

• setup didn't honor CC, CXX, FC from the environment

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  jturney

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Commits on Feb 16, 2016

• Adds support for interfacing with Ambit.

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Commits on Feb 1, 2016

• Merge branch 'master' of https://github.com/psi4/psi4public

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  loriab

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Commits on Jan 27, 2016

• fixed syntax in setup for older python versions

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  psi-rking

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Commits on Jan 23, 2016

• setup setup for metapackage

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  loriab

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Commits on Jan 19, 2016

• PCMSolver is no longer a git submodule.

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  Roberto Di Remigio

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Commits on Jan 14, 2016

• CheMPS2 & PCMSolver ON by default. on/off logic computed in CMakeLists.txt *not* setup. closes psi4/psi4/issues/122

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  loriab

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Commits on Aug 28, 2015

• Added missing references to dft section

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  Wallace Derricotte

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Commits on Jul 15, 2015

• Setup is now python3 compatible.

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  dgasmith

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Commits on Jun 23, 2015

• Made building CheMPS2 off by default

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  ryanmrichard

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Commits on Jun 6, 2015

• fix setup so enable/disable add-ons. otherwise would have to have --normally-disabled-add-on --no-normally-enabled-add-on. this way can have --normally-enabled-add-on off --normally-disabled-add-on on

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  loriab

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Commits on Jun 5, 2015

• slight clean-up of setup: remove inconsistent =, remove unused argument, rename build math, clarify explicit_libs role

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  loriab

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Commits on Jun 3, 2015

• CheMPS2: add flags to setup, forward blas/gsl/hdf5 values from psi4 to chemps2 build

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  loriab

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• zlib: add argument to setup, fail pcmsolver if not found (in line w/chemps2)

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Commits on Apr 19, 2015

• fix dependency issue & add advice to spare other hopeful system boost users many hours

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  loriab

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Commits on Apr 17, 2015

• turn off auto-building of example plugins (fpic now always invoked so not serving old --with-plugins purpose)

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  loriab

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Commits on Mar 26, 2015

• setup script properly pass along quotes in option values with spaces

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  loriab

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Commits on Feb 13, 2015

• Huge Update of LibFrag and addition of a bunch of other cool features like a parallel timer, progress bars, and a sexy molecule manipulation suite

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  ryanmrichard

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Commits on Jan 20, 2015

• Merge branch 'master' into pcm_scf

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  Roberto Di Remigio

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Commits on Jan 5, 2015

• Fixed conflicts with trunk

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  ryanmrichard

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• GTFock works

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  ryanmrichard

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Commits on Jan 4, 2015

• PCM complies with new Fortran policy

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  Roberto Di Remigio

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• Fortran support modifications following Jet's remark (see issue #89 discussion)

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  Roberto Di Remigio

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Commits on Dec 19, 2014

• Fortran is needed only for ERD and DKH.

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  Roberto Di Remigio

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Commits on Nov 25, 2014

• New Find*.cmake modules added for detection of libdl, libm, librt and libutil. Refactor (again) Python detection.

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  Roberto Di Remigio

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Commits on Nov 21, 2014

• Merge branch 'master' of github.com:psi4/psi4

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  Roberto Di Remigio

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• Fixes for Daniel's Python problem and David's MKL detection problem

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  Roberto Di Remigio

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• Removes printing I added to setup

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  jturney

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• setup was removing the build directory when an error occurred and I was still in it.

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  jturney

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• Allows user to run setup in another directory.

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  jturney

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