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Commits on Apr 20, 2016

• remove "set global" addressing bullet 3 of psi4/psi4#349

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  loriab

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Commits on Apr 4, 2016

• Cleaned up CC printing and updated output.ref's

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  dgasmith

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• Refreshed all tests/*/output.ref's for the Psi4 release. dft1, dft2, and docs-dft remain due to specific issues

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  dgasmith

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Commits on Jan 8, 2016

• moved 15 quicktests to shorttests

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  Tianyuan Zhang

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Commits on Mar 6, 2015

• All Makefile.in, MakeVars.in and MakeRules.in removed. configure.ac and m4 removed. Bye bye autotools

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  Roberto Di Remigio

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Commits on Nov 3, 2014

• Save work on refactoring CMake infrastructure for tests

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  Roberto Di Remigio

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Commits on Jan 23, 2012

• Updated physical constants. Test suite updated accordingly, with otput.ref files provided for all tests. The samples directory has been updated, because a number of test inputs were cleaned up, a…

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  andysim

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Commits on Jan 17, 2012

• Added default memory explicitly to the test inputs.

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  andysim

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• Added automatic clean function, and removed explicit clean() calls in the test inputs.

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  andysim

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Commits on Jan 15, 2012

• Merge branch 'master' of sirius.chem.vt.edu:psi4

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  lothian

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Commits on Jan 13, 2012

• Standardize CONV options. psimrcc-sp1 test case may be unstable. Specifics below.

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  loriab

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Commits on Jan 10, 2012

• Mods to inputs for cc1 and cc2. Adding cc3 (but it's not working yet).

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  lothian

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Commits on Jan 9, 2012

• remove wfn and dertype from test case inputs; other minor changes

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  tparker36

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Commits on Nov 8, 2011

• More modifications of SCF ENERGY

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  loriab

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Commits on Oct 17, 2011

• Fix cc test cases after variable name updates

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  loriab

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Commits on Aug 8, 2011

• Reverted to revision 2034.

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  jturney

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Commits on Aug 7, 2011

• Propagator code just imported from my Psi3, which is though not yet fully-featured and some nasty. So it will be rewritten soon!

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  saitow

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Commits on Feb 16, 2011

• Fixed liboptions to work with the new parser and updated test cases/Python procedures accordingly. Fixed a bug in molecule that caused Valgrind to complain.

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  andysim

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Commits on Feb 3, 2011

• The test cases have been cleaned up a little bit. They are now automatically copied over to samples, with the testing stuff removed. The manual gives details of the samples available, as does the…

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  andysim

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• Mints wrapper fixed

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  rparrish

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Commits on Jan 25, 2011

• fixed double frees due to Wavefunction owning some arrays

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  jturney

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Commits on Jan 24, 2011

• Added new scf4 case, to demonstate loops. Restored some of the cc tests; 2 are broken and have been omitted. Rob's cool new psio handler's psiclean() method is now bound to the python clean() fun…

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  andysim

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Commits on Jan 20, 2011

• Try #2....SVN CI got hung up when trying to transmit the file

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  kennedy

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