forked from psi4/psi4
/
.gitignore
138 lines (123 loc) · 2.22 KB
/
.gitignore
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# The configure script
conf
configure*
do-configure*
build.sh
# configure scratch location
autom4te.cache
# QtCreator project files
*.config
*.creator*
*.files
*.includes
CMakeLists.txt.user
# Files resulting from compilation
*.o
*.a
*.so
*.d
# Hidden files (swap)
.*
# Compiled Python files. Regenerated automatically
*.pyc
*.pyo
# Generated by cpython 3.x
__pycache__
# Python profiling output
*.pyprof
*.calltree
# Python coverage output directory
_coverage_html
# Files resulting from running PSI4
ijk.dat
output.dat
*.out
*.32
*.clean
*timer.dat
*.molden
# Special test cases
tests/*/iter.dat
tests/*/*.in
tests/*/*.rst
tests/*/*/*.h5
tests/*/*/*.intco
tests/docs*/*.txt
tests/pcmsolver/*/*OUT*
tests/pcmsolver/*/cavity*
tests/pcmsolver/*/*pcmsolver.inp
tests/*/PCM_matrix
tests/*/PEDRA.OUT
tests/*/cavity.npz
tests/*/cavity.off
tests/*/pcmsolver.inp
tests/*/*.xyz
tests/*/*.grad
tests/*/*.hess
tests/*/grid_esp.dat
tests/*/grid_field.dat
# Automatically generated files
share/python/pcm_placeholder.py
plugins/skeleton/input.dat
plugins/skeletonambit/input.dat
plugins/skeletonaointegrals/input.dat
plugins/skeletonmointegrals/input.dat
plugins/skeletonscf/input.dat
plugins/skeletonsointegrals/input.dat
plugins/skeletonwavefunction/input.dat
# Compilation directories that people use
obj*
*objdir
build
debug
debug_latest
*.sh
TEST
# Other random files people have added.
svn_source
psi4.xcodeproj
update_debug_latest.sh
#Files created by Global Arrays when it is built
include/armci.h
include/chemio.h
include/coms.h
include/dra.fh
include/dra.h
include/eaf.fh
include/eaf.h
include/elio.h
include/error.h
include/farg.h
include/ga-mpi.fh
include/ga-mpi.h
include/ga-papi.h
include/ga-wapi.h
include/ga.h
include/gacommon.h
include/global.fh
include/gpc.h
include/macdecls.h
include/macommon.h
include/maf2c.fh
include/mafdecls.fh
include/matypes.h
include/message.h
include/msgtypesc.h
include/msgtypesf.h
include/parmci.h
include/scope.h
include/sf.fh
include/sf.h
include/string-util.h
include/table.h
include/tcgmsg.fh
include/tcgmsg.h
include/typesf2c.h
bin/adjust.x
bin/collisions.x
bin/ga-config
# Ignore cdash.py and cdash.run scripts
cdash/cdash.py
cdash/cdash.run
# Ignore Jet's Vagrantfile (might be added later for auto testing)
Vagrantfile