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authorMaho Nakata <maho@FreeBSD.org>2008-07-23 09:27:10 +0000
committerMaho Nakata <maho@FreeBSD.org>2008-07-23 09:27:10 +0000
commita2a286f2cb35ecaeba64f2ffe7acf53a527e8bf5 (patch)
treec650d0c8d883983b30cfb342bf8fdb6ff72c671f /science/psi3/pkg-plist
parentdc563830de040fa8307526f238001f4006e4f55a (diff)
downloadports-a2a286f2cb35ecaeba64f2ffe7acf53a527e8bf5.tar.gz
ports-a2a286f2cb35ecaeba64f2ffe7acf53a527e8bf5.zip
Notes
Diffstat (limited to 'science/psi3/pkg-plist')
-rw-r--r--science/psi3/pkg-plist559
1 files changed, 384 insertions, 175 deletions
diff --git a/science/psi3/pkg-plist b/science/psi3/pkg-plist
index 95a60ccd9758..6f881ce583fc 100644
--- a/science/psi3/pkg-plist
+++ b/science/psi3/pkg-plist
@@ -1,7 +1,6 @@
bin/ccdensity
bin/ccenergy
bin/cceom
-bin/cceom-d
bin/cchbar
bin/cclambda
bin/ccresponse
@@ -19,6 +18,7 @@ bin/detci
bin/extrema
bin/geom
bin/input
+bin/intder
bin/localize
bin/mocube
bin/mp2
@@ -32,6 +32,7 @@ bin/response
bin/stable
bin/tocprint
bin/transqt
+bin/transqt2
include/ccfiles.h
include/chkpt_params.h
include/libbasis/basisset.h
@@ -64,7 +65,6 @@ include/libipv1/scan.gbl
include/libipv1/tmpl.h
include/libipv1/y.tab.gbl
include/libiwl/iwl.h
-include/libpsio/psio.gbl
include/libpsio/psio.h
include/libqt/qt.h
include/libr12/libr12.h
@@ -86,429 +86,604 @@ lib/libPSI_iwl.a
lib/libPSI_psio.a
lib/libPSI_qt.a
lib/libPSI_r12.a
-@dirrm include/libr12
-@dirrm include/libqt
-@dirrm include/libpsio
-@dirrm include/libiwl
-@dirrm include/libipv1
-@dirrm include/libint
-@dirrm include/libdpd
-@dirrm include/libderiv
-@dirrm include/libciomr
-@dirrm include/libchkpt
-@dirrm include/libbasis
-%%PORTDOCS%%share/psi3/pbasis.dat
-%%PORTDOCS%%share/psi3/psi.dat
-%%PORTDOCS%%%%DOCSDIR%%/libpsio.html
-%%PORTDOCS%%%%DOCSDIR%%/libdpd.html
-%%PORTDOCS%%%%DOCSDIR%%/cints.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/commandline.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/compile.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/description.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/examples.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/home.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/keywords.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/references.html
-%%PORTDOCS%%%%DOCSDIR%%/CINTS/toc.html
-%%PORTDOCS%%%%DOCSDIR%%/libqt.txt
-%%PORTDOCS%%%%DOCSDIR%%/libiwl.txt
-%%PORTDOCS%%%%DOCSDIR%%/installation.pdf
-%%PORTDOCS%%%%DOCSDIR%%/userman.pdf
-%%PORTDOCS%%%%DOCSDIR%%/progman.pdf
-%%PORTDOCS%%@dirrm share/doc/psi3/CINTS
-%%PORTDOCS%%@dirrm %%DOCSDIR%%
-%%EXAMPLESDIR%%/MakeRules.in
-%%EXAMPLESDIR%%/INDEX
%%EXAMPLESDIR%%/Basis_Tests/Benchmarks
%%EXAMPLESDIR%%/Basis_Tests/input.dat
%%EXAMPLESDIR%%/Basis_Tests/psi_test.pl
%%EXAMPLESDIR%%/Basis_Tests/standard.input
+%%EXAMPLESDIR%%/INDEX
+%%EXAMPLESDIR%%/MakeRules
+%%EXAMPLESDIR%%/MakeRules.in
+%%EXAMPLESDIR%%/MakeVars
%%EXAMPLESDIR%%/MakeVars.in
+%%EXAMPLESDIR%%/Makefile
%%EXAMPLESDIR%%/Makefile.in
-%%EXAMPLESDIR%%/driver.test.pl
-%%EXAMPLESDIR%%/psitest.pl
-%%EXAMPLESDIR%%/runtest.pl.in
+%%EXAMPLESDIR%%/README-NEW-TESTS
+%%EXAMPLESDIR%%/casscf-fzc-sp/Makefile
+%%EXAMPLESDIR%%/casscf-fzc-sp/Makefile.in
+%%EXAMPLESDIR%%/casscf-fzc-sp/input.dat
+%%EXAMPLESDIR%%/casscf-fzc-sp/output.ref
+%%EXAMPLESDIR%%/casscf-fzc-sp/psi.file14.ref
+%%EXAMPLESDIR%%/casscf-sa-sp/Makefile
+%%EXAMPLESDIR%%/casscf-sa-sp/Makefile.in
+%%EXAMPLESDIR%%/casscf-sa-sp/input.dat
+%%EXAMPLESDIR%%/casscf-sa-sp/output.ref
+%%EXAMPLESDIR%%/casscf-sa-sp/psi.file14.ref
+%%EXAMPLESDIR%%/casscf-sp/Makefile
%%EXAMPLESDIR%%/casscf-sp/Makefile.in
-%%EXAMPLESDIR%%/casscf-sp/casscf-sp.test.pl
-%%EXAMPLESDIR%%/casscf-sp/file14.ref
%%EXAMPLESDIR%%/casscf-sp/input.dat
%%EXAMPLESDIR%%/casscf-sp/output.ref
-%%EXAMPLESDIR%%/casscf-sp/Makefile
+%%EXAMPLESDIR%%/casscf-sp/psi.file14.ref
+%%EXAMPLESDIR%%/cc1/Makefile
%%EXAMPLESDIR%%/cc1/Makefile.in
-%%EXAMPLESDIR%%/cc1/cc1.test.pl
%%EXAMPLESDIR%%/cc1/file11.ref
%%EXAMPLESDIR%%/cc1/input.dat
%%EXAMPLESDIR%%/cc1/output.ref
-%%EXAMPLESDIR%%/cc1/Makefile
+%%EXAMPLESDIR%%/cc10/Makefile
%%EXAMPLESDIR%%/cc10/Makefile.in
-%%EXAMPLESDIR%%/cc10/cc10.test.pl
%%EXAMPLESDIR%%/cc10/input.dat
%%EXAMPLESDIR%%/cc10/output.ref
-%%EXAMPLESDIR%%/cc10/Makefile
+%%EXAMPLESDIR%%/cc11/Makefile
%%EXAMPLESDIR%%/cc11/Makefile.in
-%%EXAMPLESDIR%%/cc11/cc11.test.pl
%%EXAMPLESDIR%%/cc11/input.dat
%%EXAMPLESDIR%%/cc11/output.ref
-%%EXAMPLESDIR%%/cc11/Makefile
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%%EXAMPLESDIR%%/cc12/Makefile.in
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%%EXAMPLESDIR%%/cc12/input.dat
%%EXAMPLESDIR%%/cc12/output.ref
-%%EXAMPLESDIR%%/cc12/Makefile
+%%EXAMPLESDIR%%/cc13/Makefile
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-%%EXAMPLESDIR%%/cc13/cc13.test.pl
%%EXAMPLESDIR%%/cc13/file11.ref
%%EXAMPLESDIR%%/cc13/input.dat
%%EXAMPLESDIR%%/cc13/output.ref
-%%EXAMPLESDIR%%/cc13/Makefile
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%%EXAMPLESDIR%%/cc14/file11.ref
%%EXAMPLESDIR%%/cc14/input.dat
%%EXAMPLESDIR%%/cc14/output.ref
-%%EXAMPLESDIR%%/cc14/Makefile
+%%EXAMPLESDIR%%/cc15/Makefile
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%%EXAMPLESDIR%%/cc15/input.dat
%%EXAMPLESDIR%%/cc15/output.ref
-%%EXAMPLESDIR%%/cc15/Makefile
+%%EXAMPLESDIR%%/cc16/Makefile
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%%EXAMPLESDIR%%/cc16/input.dat
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%%EXAMPLESDIR%%/cc17/Makefile.in
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%%EXAMPLESDIR%%/cc17/input.dat
%%EXAMPLESDIR%%/cc17/output.ref
-%%EXAMPLESDIR%%/cc17/Makefile
+%%EXAMPLESDIR%%/cc18/Makefile
%%EXAMPLESDIR%%/cc18/Makefile.in
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%%EXAMPLESDIR%%/cc18/input.dat
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-%%EXAMPLESDIR%%/cc18/Makefile
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%%EXAMPLESDIR%%/cc19/input.dat
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-%%EXAMPLESDIR%%/cc19/Makefile
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%%EXAMPLESDIR%%/cc2/file11.ref
%%EXAMPLESDIR%%/cc2/input.dat
%%EXAMPLESDIR%%/cc2/output.ref
-%%EXAMPLESDIR%%/cc2/Makefile
+%%EXAMPLESDIR%%/cc21/Makefile
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+%%EXAMPLESDIR%%/cc21/input.dat
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+%%EXAMPLESDIR%%/cc22/Makefile
+%%EXAMPLESDIR%%/cc22/Makefile.in
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+%%EXAMPLESDIR%%/cc22/output.ref
+%%EXAMPLESDIR%%/cc23/Makefile
+%%EXAMPLESDIR%%/cc23/Makefile.in
+%%EXAMPLESDIR%%/cc23/file11.ref
+%%EXAMPLESDIR%%/cc23/input.dat
+%%EXAMPLESDIR%%/cc23/output.ref
+%%EXAMPLESDIR%%/cc24/Makefile
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+%%EXAMPLESDIR%%/cc24/input.dat
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+%%EXAMPLESDIR%%/cc25/Makefile
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+%%EXAMPLESDIR%%/cc25/input.dat
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+%%EXAMPLESDIR%%/cc26/Makefile
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+%%EXAMPLESDIR%%/cc27/Makefile
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+%%EXAMPLESDIR%%/cc29/input.dat
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%%EXAMPLESDIR%%/cc3/output.ref
-%%EXAMPLESDIR%%/cc3/Makefile
+%%EXAMPLESDIR%%/cc30/Makefile
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-%%EXAMPLESDIR%%/cc4/Makefile
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%%EXAMPLESDIR%%/cc5/filesizes
%%EXAMPLESDIR%%/cc5/input.dat
%%EXAMPLESDIR%%/cc5/output.ref
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-%%EXAMPLESDIR%%/cc6/Makefile
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%%EXAMPLESDIR%%/cc8/input.dat
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%%EXAMPLESDIR%%/cc9/input.dat
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+%%EXAMPLESDIR%%/ci-tdm/input.dat
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-%%EXAMPLESDIR%%/psi_start/Makefile
-%%EXAMPLESDIR%%/psi_start/psi_start.pl
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+%%EXAMPLESDIR%%/rasscf-sp/input.dat
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-%%EXAMPLESDIR%%/rhf-lindep1/Makefile
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%%EXAMPLESDIR%%/rhf-oeprop/input.dat
%%EXAMPLESDIR%%/rhf-oeprop/mo.cube.ref
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-%%EXAMPLESDIR%%/rhf-oeprop/Makefile
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+%%EXAMPLESDIR%%/rhf-stab/rhf-stab.pl
%%EXAMPLESDIR%%/rhf-stab/rhf-stab.pl.in
%%EXAMPLESDIR%%/rhf-stab/rhf-stab.test.pl
-%%EXAMPLESDIR%%/rhf-stab/Makefile
-%%EXAMPLESDIR%%/rhf-stab/rhf-stab.pl
+%%EXAMPLESDIR%%/rohf-lindep1/Makefile
+%%EXAMPLESDIR%%/rohf-lindep1/Makefile.in
+%%EXAMPLESDIR%%/rohf-lindep1/input.dat
+%%EXAMPLESDIR%%/rohf-lindep1/output.ref
+%%EXAMPLESDIR%%/rohf-stab/Makefile
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%%EXAMPLESDIR%%/rohf-stab/output.ref
+%%EXAMPLESDIR%%/rohf-stab/rohf-stab.pl
%%EXAMPLESDIR%%/rohf-stab/rohf-stab.pl.in
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-%%EXAMPLESDIR%%/rohf-stab/Makefile
-%%EXAMPLESDIR%%/rohf-stab/rohf-stab.pl
-%%EXAMPLESDIR%%/rohf-lindep1/Makefile.in
-%%EXAMPLESDIR%%/rohf-lindep1/input.dat
-%%EXAMPLESDIR%%/rohf-lindep1/output.ref
-%%EXAMPLESDIR%%/rohf-lindep1/Makefile
-%%EXAMPLESDIR%%/rohf-grad1/Makefile
-%%EXAMPLESDIR%%/rohf-grad1/Makefile.in
-%%EXAMPLESDIR%%/rohf-grad1/file11.ref
-%%EXAMPLESDIR%%/rohf-grad1/input.dat
-%%EXAMPLESDIR%%/rohf-grad1/output.ref
+%%EXAMPLESDIR%%/runtest.pl
+%%EXAMPLESDIR%%/runtest.pl.in
+%%EXAMPLESDIR%%/scf-fc-numer/Makefile
+%%EXAMPLESDIR%%/scf-fc-numer/Makefile.in
+%%EXAMPLESDIR%%/scf-fc-numer/file11.ref
+%%EXAMPLESDIR%%/scf-fc-numer/input.dat
+%%EXAMPLESDIR%%/scf-fc-numer/output.ref
+%%EXAMPLESDIR%%/scf-fc-numer/scf-fc-numer-test.pl
+%%EXAMPLESDIR%%/scf-freq-first-3/Makefile
+%%EXAMPLESDIR%%/scf-freq-first-3/Makefile.in
+%%EXAMPLESDIR%%/scf-freq-first-3/file11.ref
+%%EXAMPLESDIR%%/scf-freq-first-3/input.dat
+%%EXAMPLESDIR%%/scf-freq-first-3/output.ref
+%%EXAMPLESDIR%%/scf-freq-first-3/scf-freq-first-3.test.pl
+%%EXAMPLESDIR%%/scf-freq-first-5/Makefile
+%%EXAMPLESDIR%%/scf-freq-first-5/Makefile.in
+%%EXAMPLESDIR%%/scf-freq-first-5/file11.ref
+%%EXAMPLESDIR%%/scf-freq-first-5/input.dat
+%%EXAMPLESDIR%%/scf-freq-first-5/output.ref
+%%EXAMPLESDIR%%/scf-freq-first-5/scf-freq-first-5.test.pl
+%%EXAMPLESDIR%%/scf-freq-none-3/Makefile
+%%EXAMPLESDIR%%/scf-freq-none-3/Makefile.in
+%%EXAMPLESDIR%%/scf-freq-none-3/input.dat
+%%EXAMPLESDIR%%/scf-freq-none-3/output.ref
+%%EXAMPLESDIR%%/scf-freq-none-3/scf-freq-none-3.test.pl
+%%EXAMPLESDIR%%/scf-freq-none-5/Makefile
+%%EXAMPLESDIR%%/scf-freq-none-5/Makefile.in
+%%EXAMPLESDIR%%/scf-freq-none-5/input.dat
+%%EXAMPLESDIR%%/scf-freq-none-5/output.ref
+%%EXAMPLESDIR%%/scf-freq-none-5/scf-freq-none-5.test.pl
+%%EXAMPLESDIR%%/scf-freq/Makefile
%%EXAMPLESDIR%%/scf-freq/Makefile.in
%%EXAMPLESDIR%%/scf-freq/file15.ref
%%EXAMPLESDIR%%/scf-freq/file17.ref
%%EXAMPLESDIR%%/scf-freq/input.dat
%%EXAMPLESDIR%%/scf-freq/output.ref
%%EXAMPLESDIR%%/scf-freq/scf-freq.test.pl
-%%EXAMPLESDIR%%/scf-freq/Makefile
-%%EXAMPLESDIR%%/scf-freq-numer/Makefile.in
-%%EXAMPLESDIR%%/scf-freq-numer/file11.ref
-%%EXAMPLESDIR%%/scf-freq-numer/input.dat
-%%EXAMPLESDIR%%/scf-freq-numer/output.ref
-%%EXAMPLESDIR%%/scf-freq-numer/scf-freq-numer.test.pl
-%%EXAMPLESDIR%%/scf-freq-numer/Makefile
-%%EXAMPLESDIR%%/scf-freq-symm-numer/Makefile.in
-%%EXAMPLESDIR%%/scf-freq-symm-numer/file11.ref
-%%EXAMPLESDIR%%/scf-freq-symm-numer/input.dat
-%%EXAMPLESDIR%%/scf-freq-symm-numer/output.ref
-%%EXAMPLESDIR%%/scf-freq-symm-numer/scf-freq-symm-numer.test.pl
-%%EXAMPLESDIR%%/scf-freq-symm-numer/Makefile
-%%EXAMPLESDIR%%/scf-opt/Makefile.in
-%%EXAMPLESDIR%%/scf-opt/file11.ref
-%%EXAMPLESDIR%%/scf-opt/input.dat
-%%EXAMPLESDIR%%/scf-opt/output.ref
-%%EXAMPLESDIR%%/scf-opt/scf-opt.test.pl
-%%EXAMPLESDIR%%/scf-opt/Makefile
+%%EXAMPLESDIR%%/scf-opt-numer/Makefile
%%EXAMPLESDIR%%/scf-opt-numer/Makefile.in
%%EXAMPLESDIR%%/scf-opt-numer/file11.ref
%%EXAMPLESDIR%%/scf-opt-numer/input.dat
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%%EXAMPLESDIR%%/scf-opt-numer/scf-opt-numer.test.pl
-%%EXAMPLESDIR%%/scf-opt-numer/Makefile
+%%EXAMPLESDIR%%/scf-opt/Makefile
+%%EXAMPLESDIR%%/scf-opt/Makefile.in
+%%EXAMPLESDIR%%/scf-opt/file11.ref
+%%EXAMPLESDIR%%/scf-opt/input.dat
+%%EXAMPLESDIR%%/scf-opt/output.ref
+%%EXAMPLESDIR%%/scf-opt/scf-opt.test.pl
+%%EXAMPLESDIR%%/scf-opt10/Makefile
%%EXAMPLESDIR%%/scf-opt10/Makefile.in
%%EXAMPLESDIR%%/scf-opt10/file11.ref
%%EXAMPLESDIR%%/scf-opt10/input.dat
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%%EXAMPLESDIR%%/scf-opt10/scf-opt10.test.pl
-%%EXAMPLESDIR%%/scf-opt10/Makefile
+%%EXAMPLESDIR%%/scf-opt11/Makefile
%%EXAMPLESDIR%%/scf-opt11/Makefile.in
%%EXAMPLESDIR%%/scf-opt11/file11.ref
%%EXAMPLESDIR%%/scf-opt11/input.dat
%%EXAMPLESDIR%%/scf-opt11/output.ref
%%EXAMPLESDIR%%/scf-opt11/scf-opt11.test.pl
-%%EXAMPLESDIR%%/scf-opt11/Makefile
+%%EXAMPLESDIR%%/scf-opt12/Makefile
+%%EXAMPLESDIR%%/scf-opt12/Makefile.in
+%%EXAMPLESDIR%%/scf-opt12/file11.ref
+%%EXAMPLESDIR%%/scf-opt12/input.dat
+%%EXAMPLESDIR%%/scf-opt12/output.ref
+%%EXAMPLESDIR%%/scf-opt12/scf-opt12.test.pl
+%%EXAMPLESDIR%%/scf-opt2-numer/Makefile
+%%EXAMPLESDIR%%/scf-opt2-numer/Makefile.in
+%%EXAMPLESDIR%%/scf-opt2-numer/file11.ref
+%%EXAMPLESDIR%%/scf-opt2-numer/input.dat
+%%EXAMPLESDIR%%/scf-opt2-numer/output.ref
+%%EXAMPLESDIR%%/scf-opt2-numer/scf-opt2-numer.test.pl
+%%EXAMPLESDIR%%/scf-opt2/Makefile
%%EXAMPLESDIR%%/scf-opt2/Makefile.in
%%EXAMPLESDIR%%/scf-opt2/file11.ref
%%EXAMPLESDIR%%/scf-opt2/input.dat
%%EXAMPLESDIR%%/scf-opt2/output.ref
%%EXAMPLESDIR%%/scf-opt2/scf-opt2.test.pl
-%%EXAMPLESDIR%%/scf-opt2/Makefile
+%%EXAMPLESDIR%%/scf-opt3/Makefile
%%EXAMPLESDIR%%/scf-opt3/Makefile.in
%%EXAMPLESDIR%%/scf-opt3/file11.ref
%%EXAMPLESDIR%%/scf-opt3/input.dat
%%EXAMPLESDIR%%/scf-opt3/output.ref
%%EXAMPLESDIR%%/scf-opt3/scf-opt3.test.pl
-%%EXAMPLESDIR%%/scf-opt3/Makefile
+%%EXAMPLESDIR%%/scf-opt4/Makefile
%%EXAMPLESDIR%%/scf-opt4/Makefile.in
%%EXAMPLESDIR%%/scf-opt4/file11.ref
%%EXAMPLESDIR%%/scf-opt4/input.dat
%%EXAMPLESDIR%%/scf-opt4/output.ref
%%EXAMPLESDIR%%/scf-opt4/scf-opt4.test.pl
-%%EXAMPLESDIR%%/scf-opt4/Makefile
+%%EXAMPLESDIR%%/scf-opt5/Makefile
%%EXAMPLESDIR%%/scf-opt5/Makefile.in
%%EXAMPLESDIR%%/scf-opt5/file11.ref
%%EXAMPLESDIR%%/scf-opt5/input.dat
%%EXAMPLESDIR%%/scf-opt5/output.ref
%%EXAMPLESDIR%%/scf-opt5/scf-opt5.test.pl
-%%EXAMPLESDIR%%/scf-opt5/Makefile
+%%EXAMPLESDIR%%/scf-opt6/Makefile
%%EXAMPLESDIR%%/scf-opt6/Makefile.in
%%EXAMPLESDIR%%/scf-opt6/file11.ref
%%EXAMPLESDIR%%/scf-opt6/input.dat
%%EXAMPLESDIR%%/scf-opt6/output.ref
%%EXAMPLESDIR%%/scf-opt6/scf-opt6.test.pl
-%%EXAMPLESDIR%%/scf-opt6/Makefile
+%%EXAMPLESDIR%%/scf-opt7/Makefile
%%EXAMPLESDIR%%/scf-opt7/Makefile.in
%%EXAMPLESDIR%%/scf-opt7/file11.ref
%%EXAMPLESDIR%%/scf-opt7/input.dat
%%EXAMPLESDIR%%/scf-opt7/output.ref
%%EXAMPLESDIR%%/scf-opt7/scf-opt7.test.pl
-%%EXAMPLESDIR%%/scf-opt7/Makefile
-%%EXAMPLESDIR%%/scf-opt8/Makefile.in
-%%EXAMPLESDIR%%/scf-opt8/file11.ref
-%%EXAMPLESDIR%%/scf-opt8/input.dat
-%%EXAMPLESDIR%%/scf-opt8/output.ref
-%%EXAMPLESDIR%%/scf-opt8/scf-opt8.test.pl
-%%EXAMPLESDIR%%/scf-opt8/Makefile
+%%EXAMPLESDIR%%/scf-opt9/Makefile
%%EXAMPLESDIR%%/scf-opt9/Makefile.in
%%EXAMPLESDIR%%/scf-opt9/file11.ref
%%EXAMPLESDIR%%/scf-opt9/input.dat
%%EXAMPLESDIR%%/scf-opt9/output.ref
%%EXAMPLESDIR%%/scf-opt9/scf-opt9.test.pl
-%%EXAMPLESDIR%%/scf-opt9/Makefile
+%%EXAMPLESDIR%%/scf-polar/Makefile
%%EXAMPLESDIR%%/scf-polar/Makefile.in
%%EXAMPLESDIR%%/scf-polar/input.dat
%%EXAMPLESDIR%%/scf-polar/output.ref
%%EXAMPLESDIR%%/scf-polar/scf-polar.test.pl
-%%EXAMPLESDIR%%/scf-polar/Makefile
+%%EXAMPLESDIR%%/scf-symm-fc-numer/Makefile
+%%EXAMPLESDIR%%/scf-symm-fc-numer/Makefile.in
+%%EXAMPLESDIR%%/scf-symm-fc-numer/file11.ref
+%%EXAMPLESDIR%%/scf-symm-fc-numer/input.dat
+%%EXAMPLESDIR%%/scf-symm-fc-numer/output.ref
+%%EXAMPLESDIR%%/scf-symm-fc-numer/scf-symm-fc-numer.pl
+%%EXAMPLESDIR%%/uhf-lindep1/Makefile
%%EXAMPLESDIR%%/uhf-lindep1/Makefile.in
%%EXAMPLESDIR%%/uhf-lindep1/input.dat
%%EXAMPLESDIR%%/uhf-lindep1/output.ref
-%%EXAMPLESDIR%%/uhf-lindep1/Makefile
-%%EXAMPLESDIR%%/uhf-stab/Makefile.in
-%%EXAMPLESDIR%%/uhf-stab/input.dat
-%%EXAMPLESDIR%%/uhf-stab/output.ref
-%%EXAMPLESDIR%%/uhf-stab/uhf-stab.pl.in
-%%EXAMPLESDIR%%/uhf-stab/uhf-stab.test.pl
-%%EXAMPLESDIR%%/uhf-stab/Makefile
-%%EXAMPLESDIR%%/uhf-stab/uhf-stab.pl
%%EXAMPLESDIR%%/uhf-stab-follow/Makefile.in
%%EXAMPLESDIR%%/uhf-stab-follow/input.dat
%%EXAMPLESDIR%%/uhf-stab-follow/output.ref
%%EXAMPLESDIR%%/uhf-stab-follow/uhf-stab-follow.pl.in
%%EXAMPLESDIR%%/uhf-stab-follow/uhf-stab-follow.test.pl
-%%EXAMPLESDIR%%/uhf-grad1/Makefile
-%%EXAMPLESDIR%%/uhf-grad1/Makefile.in
-%%EXAMPLESDIR%%/uhf-grad1/file11.ref
-%%EXAMPLESDIR%%/uhf-grad1/input.dat
-%%EXAMPLESDIR%%/uhf-grad1/output.ref
-%%EXAMPLESDIR%%/Makefile
-%%EXAMPLESDIR%%/MakeVars
-%%EXAMPLESDIR%%/MakeRules
-%%EXAMPLESDIR%%/runtest.pl
+%%EXAMPLESDIR%%/uhf-stab/Makefile
+%%EXAMPLESDIR%%/uhf-stab/Makefile.in
+%%EXAMPLESDIR%%/uhf-stab/input.dat
+%%EXAMPLESDIR%%/uhf-stab/output.ref
+%%EXAMPLESDIR%%/uhf-stab/uhf-stab.pl
+%%EXAMPLESDIR%%/uhf-stab/uhf-stab.pl.in
+%%EXAMPLESDIR%%/uhf-stab/uhf-stab.test.pl
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/commandline.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/compile.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/description.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/examples.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/home.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/keywords.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/references.html
+%%PORTDOCS%%%%DOCSDIR%%/CINTS/toc.html
+%%PORTDOCS%%%%DOCSDIR%%/cints.html
+%%PORTDOCS%%%%DOCSDIR%%/installation.pdf
+%%PORTDOCS%%%%DOCSDIR%%/libdpd.html
+%%PORTDOCS%%%%DOCSDIR%%/libiwl.txt
+%%PORTDOCS%%%%DOCSDIR%%/libpsio.html
+%%PORTDOCS%%%%DOCSDIR%%/libqt.txt
+%%PORTDOCS%%%%DOCSDIR%%/progman.pdf
+%%PORTDOCS%%%%DOCSDIR%%/userman.pdf
+%%PORTDOCS%%share/psi3/pbasis.dat
+%%PORTDOCS%%share/psi3/psi.dat
+%%PORTDOCS%%@dirrm share/doc/psi3/CINTS
+%%PORTDOCS%%@dirrm %%DOCSDIR%%
+@dirrm include/libr12
+@dirrm include/libqt
+@dirrm include/libpsio
+@dirrm include/libiwl
+@dirrm include/libipv1
+@dirrm include/libint
+@dirrm include/libdpd
+@dirrm include/libderiv
+@dirrm include/libciomr
+@dirrm include/libchkpt
+@dirrm include/libbasis
@dirrm %%EXAMPLESDIR%%/uhf-stab-follow
@dirrm %%EXAMPLESDIR%%/uhf-stab
-@dirrm %%EXAMPLESDIR%%/uhf-grad1
@dirrm %%EXAMPLESDIR%%/uhf-lindep1
+@dirrm %%EXAMPLESDIR%%/scf-symm-fc-numer
@dirrm %%EXAMPLESDIR%%/scf-polar
@dirrm %%EXAMPLESDIR%%/scf-opt9
-@dirrm %%EXAMPLESDIR%%/scf-opt8
@dirrm %%EXAMPLESDIR%%/scf-opt7
@dirrm %%EXAMPLESDIR%%/scf-opt6
@dirrm %%EXAMPLESDIR%%/scf-opt5
@dirrm %%EXAMPLESDIR%%/scf-opt4
@dirrm %%EXAMPLESDIR%%/scf-opt3
+@dirrm %%EXAMPLESDIR%%/scf-opt2-numer
@dirrm %%EXAMPLESDIR%%/scf-opt2
+@dirrm %%EXAMPLESDIR%%/scf-opt12
@dirrm %%EXAMPLESDIR%%/scf-opt11
@dirrm %%EXAMPLESDIR%%/scf-opt10
@dirrm %%EXAMPLESDIR%%/scf-opt-numer
@dirrm %%EXAMPLESDIR%%/scf-opt
-@dirrm %%EXAMPLESDIR%%/scf-freq-symm-numer
-@dirrm %%EXAMPLESDIR%%/scf-freq-numer
+@dirrm %%EXAMPLESDIR%%/scf-freq-none-5
+@dirrm %%EXAMPLESDIR%%/scf-freq-none-3
+@dirrm %%EXAMPLESDIR%%/scf-freq-first-5
+@dirrm %%EXAMPLESDIR%%/scf-freq-first-3
@dirrm %%EXAMPLESDIR%%/scf-freq
+@dirrm %%EXAMPLESDIR%%/scf-fc-numer
@dirrm %%EXAMPLESDIR%%/rohf-stab
@dirrm %%EXAMPLESDIR%%/rohf-lindep1
-@dirrm %%EXAMPLESDIR%%/rohf-grad1
@dirrm %%EXAMPLESDIR%%/rhf-stab
@dirrm %%EXAMPLESDIR%%/rhf-oeprop
@dirrm %%EXAMPLESDIR%%/rhf-lindep1
+@dirrm %%EXAMPLESDIR%%/rasscf-sp
@dirrm %%EXAMPLESDIR%%/psi_start
@dirrm %%EXAMPLESDIR%%/mp2r12-sp1
@dirrm %%EXAMPLESDIR%%/mp2-sp
+@dirrm %%EXAMPLESDIR%%/mp2-scs
@dirrm %%EXAMPLESDIR%%/mp2-opt-numer
+@dirrm %%EXAMPLESDIR%%/mp2-opt
@dirrm %%EXAMPLESDIR%%/mp2-oeprop
@dirrm %%EXAMPLESDIR%%/mp2-direct-sp
+@dirrm %%EXAMPLESDIR%%/fci-trans
+@dirrm %%EXAMPLESDIR%%/fci-h2o
+@dirrm %%EXAMPLESDIR%%/fci-dipole
@dirrm %%EXAMPLESDIR%%/extrema-zmat
@dirrm %%EXAMPLESDIR%%/extrema-deloc
@dirrm %%EXAMPLESDIR%%/dboc-uhf1
@@ -519,13 +694,45 @@ lib/libPSI_r12.a
@dirrm %%EXAMPLESDIR%%/cisd-sp
@dirrm %%EXAMPLESDIR%%/cisd-opt-numer
@dirrm %%EXAMPLESDIR%%/cis-sp
+@dirrm %%EXAMPLESDIR%%/cints-d1eri
+@dirrm %%EXAMPLESDIR%%/ci-tdm
@dirrm %%EXAMPLESDIR%%/cc9
@dirrm %%EXAMPLESDIR%%/cc8
@dirrm %%EXAMPLESDIR%%/cc7
@dirrm %%EXAMPLESDIR%%/cc6
+@dirrm %%EXAMPLESDIR%%/cc50
@dirrm %%EXAMPLESDIR%%/cc5
+@dirrm %%EXAMPLESDIR%%/cc49
+@dirrm %%EXAMPLESDIR%%/cc48
+@dirrm %%EXAMPLESDIR%%/cc47
+@dirrm %%EXAMPLESDIR%%/cc46
+@dirrm %%EXAMPLESDIR%%/cc45
+@dirrm %%EXAMPLESDIR%%/cc44
+@dirrm %%EXAMPLESDIR%%/cc43
+@dirrm %%EXAMPLESDIR%%/cc42
+@dirrm %%EXAMPLESDIR%%/cc41
+@dirrm %%EXAMPLESDIR%%/cc40
@dirrm %%EXAMPLESDIR%%/cc4
+@dirrm %%EXAMPLESDIR%%/cc39
+@dirrm %%EXAMPLESDIR%%/cc38
+@dirrm %%EXAMPLESDIR%%/cc37
+@dirrm %%EXAMPLESDIR%%/cc36
+@dirrm %%EXAMPLESDIR%%/cc35
+@dirrm %%EXAMPLESDIR%%/cc34
+@dirrm %%EXAMPLESDIR%%/cc33
+@dirrm %%EXAMPLESDIR%%/cc32
+@dirrm %%EXAMPLESDIR%%/cc31
+@dirrm %%EXAMPLESDIR%%/cc30
@dirrm %%EXAMPLESDIR%%/cc3
+@dirrm %%EXAMPLESDIR%%/cc29
+@dirrm %%EXAMPLESDIR%%/cc28
+@dirrm %%EXAMPLESDIR%%/cc27
+@dirrm %%EXAMPLESDIR%%/cc26
+@dirrm %%EXAMPLESDIR%%/cc25
+@dirrm %%EXAMPLESDIR%%/cc24
+@dirrm %%EXAMPLESDIR%%/cc23
+@dirrm %%EXAMPLESDIR%%/cc22
+@dirrm %%EXAMPLESDIR%%/cc21
@dirrm %%EXAMPLESDIR%%/cc2
@dirrm %%EXAMPLESDIR%%/cc19
@dirrm %%EXAMPLESDIR%%/cc18
@@ -539,6 +746,8 @@ lib/libPSI_r12.a
@dirrm %%EXAMPLESDIR%%/cc10
@dirrm %%EXAMPLESDIR%%/cc1
@dirrm %%EXAMPLESDIR%%/casscf-sp
+@dirrm %%EXAMPLESDIR%%/casscf-sa-sp
+@dirrm %%EXAMPLESDIR%%/casscf-fzc-sp
@dirrm %%EXAMPLESDIR%%/Basis_Tests
@dirrm %%EXAMPLESDIR%%
@dirrm %%DATADIR%%