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one more ctor for XCOperator to be able to construct outside SCF/Nemo Linux/MacOS Build #1984: Commit 7084146 pushed by evaleev
November 22, 2024 14:52 47m 54s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 22, 2024 14:52 47m 54s
one more ctor for XCOperator to be able to construct outside SCF/Nemo Linux/MacOS Build #1983: Commit 0d9f648 pushed by evaleev
November 21, 2024 14:12 48m 22s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 21, 2024 14:12 48m 22s
opne more ctor for XCOperator to be able to construct outside SCF/Nemo Linux/MacOS Build #1982: Commit e22831b pushed by evaleev
November 21, 2024 14:12 49m 50s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 21, 2024 14:12 49m 50s
Fix for case where no aligned_alloc Linux/MacOS Build #1981: Pull request #559 opened by EricaCMitchell
November 18, 2024 01:31 48m 49s EricaCMitchell:pr-aligned_alloc
EricaCMitchell:pr-aligned_alloc
November 18, 2024 01:31 48m 49s
some cleanup for LRCC2 Linux/MacOS Build #1980: Commit 81497a4 pushed by fbischoff
November 14, 2024 16:00 48m 48s pr-fix-cc2
pr-fix-cc2
November 14, 2024 16:00 48m 48s
bump actions/{ccache,checkout} to v4 Linux/MacOS Build #1979: Commit 7735821 pushed by evaleev
November 14, 2024 02:18 48m 40s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 14, 2024 02:18 48m 40s
Truncation of Gaussian expansion of integral kernel in SeparatedConvo… Linux/MacOS Build #1978: Commit 147c7b5 pushed by evaleev
November 13, 2024 18:19 47m 47s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 13, 2024 18:19 47m 47s
Truncation of Gaussian expansion of integral kernel in SeparatedConvo… Linux/MacOS Build #1977: Commit 9ed6314 pushed by evaleev
November 13, 2024 03:54 48m 24s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 13, 2024 03:54 48m 24s
include raw solidharmonics content ... needs cleaning Linux/MacOS Build #1976: Commit dad26c3 pushed by robertjharrison
November 12, 2024 13:28 1m 52s bspline
bspline
November 12, 2024 13:28 1m 52s
test bessel2 code; bspline and periodic notes Linux/MacOS Build #1975: Commit 1252774 pushed by robertjharrison
November 12, 2024 13:19 2m 51s bspline
bspline
November 12, 2024 13:19 2m 51s
Truncation of Gaussian expansion of integral kernel in SeparatedConvo… Linux/MacOS Build #1974: Commit 7022436 pushed by evaleev
November 7, 2024 17:01 49m 35s jm/cleanup/nuclear-density-functor
jm/cleanup/nuclear-density-functor
November 7, 2024 17:01 49m 35s
LRCC2 seems to work for water dimer, but singles are very slow Linux/MacOS Build #1973: Commit 84c23ef pushed by fbischoff
November 5, 2024 08:15 48m 0s pr-fix-cc2
pr-fix-cc2
November 5, 2024 08:15 48m 0s
LRCC2 works for He, singles also for water dimer, but a tensor except… Linux/MacOS Build #1972: Commit df7d831 pushed by fbischoff
November 1, 2024 12:04 48m 3s pr-fix-cc2
pr-fix-cc2
November 1, 2024 12:04 48m 3s
print memory usage using getrusage Linux/MacOS Build #1971: Commit 526696e pushed by fbischoff
October 30, 2024 16:55 48m 13s pr-fix-cc2
pr-fix-cc2
October 30, 2024 16:55 48m 13s
gs cc2 works with macrotasks and the water dimer, lrcc2 to go Linux/MacOS Build #1970: Commit a480733 pushed by fbischoff
October 30, 2024 08:01 1h 3m 39s pr-fix-cc2
pr-fix-cc2
October 30, 2024 08:01 1h 3m 39s
Json write coordinates in 1,2,3 Dimensions Linux/MacOS Build #1969: Commit 749d388 pushed by ahurta92
October 28, 2024 17:17 53m 0s pr_writecoeff
pr_writecoeff
October 28, 2024 17:17 53m 0s
Merge pull request #557 from EricaCMitchell/pr-lapack_hotfix Linux/MacOS Build #1968: Commit 67ea7b5 pushed by hborchert
October 28, 2024 14:53 37m 20s new-exchange
new-exchange
October 28, 2024 14:53 37m 20s
pages build and deployment pages-build-deployment #233: by github-pages bot
October 26, 2024 16:29 1m 24s
October 26, 2024 16:29 1m 24s
Merge pull request #557 from EricaCMitchell/pr-lapack_hotfix publish-doxygen #234: Commit 67ea7b5 pushed by evaleev
October 26, 2024 16:23 5m 43s master
master
October 26, 2024 16:23 5m 43s
Merge pull request #557 from EricaCMitchell/pr-lapack_hotfix Linux/MacOS Build #1967: Commit 67ea7b5 pushed by evaleev
October 26, 2024 16:23 36m 28s master
master
October 26, 2024 16:23 36m 28s
Hotfix for MADNESS_LINALG_USE_LAPACKE = true Linux/MacOS Build #1966: Pull request #557 opened by EricaCMitchell
October 24, 2024 21:11 2m 47s EricaCMitchell:pr-lapack_hotfix
EricaCMitchell:pr-lapack_hotfix
October 24, 2024 21:11 2m 47s
making cc2 singles more efficient by making potential storage work ag… Linux/MacOS Build #1965: Commit 734cedb pushed by fbischoff
October 24, 2024 13:21 47m 56s pr-fix-cc2
pr-fix-cc2
October 24, 2024 13:21 47m 56s
pages build and deployment pages-build-deployment #232: by github-pages bot
October 24, 2024 02:08 1m 27s
October 24, 2024 02:08 1m 27s
Merge pull request #556 from EricaCMitchell/pr-lapack_refactor Linux/MacOS Build #1964: Commit b82d6c9 pushed by evaleev
October 24, 2024 02:02 48m 29s master
master
October 24, 2024 02:02 48m 29s
Merge pull request #556 from EricaCMitchell/pr-lapack_refactor publish-doxygen #233: Commit b82d6c9 pushed by evaleev
October 24, 2024 02:02 5m 41s master
master
October 24, 2024 02:02 5m 41s