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Merge branch 'dev' into lassis_ncharge_norb
mrh continuous integration #459: Commit b1b7e71 pushed by MatthewRHermes
March 29, 2024 17:48 19m 26s lassis_ncharge_norb
March 29, 2024 17:48 19m 26s
PySCF(-forge) compatibility check & version update
mrh continuous integration #458: Commit a62881d pushed by MatthewRHermes
March 29, 2024 17:48 19m 41s dev
dev
March 29, 2024 17:48 19m 41s
Set ncharge = min (norb[i],norb[a])
mrh continuous integration #457: Commit 50593a3 pushed by MatthewRHermes
March 29, 2024 17:11 19m 16s lassis_ncharge_norb
March 29, 2024 17:11 19m 16s
reduce verbosity of unnecessary warning
mrh continuous integration #456: Commit cdf9641 pushed by MatthewRHermes
March 29, 2024 16:14 19m 3s dev
dev
March 29, 2024 16:14 19m 3s
LASSI analyze method kwargs
mrh continuous integration #455: Commit b2f9b99 pushed by MatthewRHermes
March 28, 2024 18:39 19m 33s dev
dev
March 28, 2024 18:39 19m 33s
lassis ncharge reexpress formula
mrh continuous integration #454: Commit dd3a17c pushed by MatthewRHermes
March 27, 2024 23:18 18m 44s lassis_ncharge_rationalization
March 27, 2024 23:18 18m 44s
lassis ncharge spin-agnostic
mrh continuous integration #451: Commit 76992fc pushed by MatthewRHermes
March 27, 2024 18:23 19m 59s dev
dev
March 27, 2024 18:23 19m 59s
lassis ncharge spin-agnostic
mrh continuous integration #450: Commit 76992fc pushed by MatthewRHermes
March 27, 2024 17:55 19m 52s lassis_ncharge_rationalization
March 27, 2024 17:55 19m 52s
create debug_lassis_targets_slow.py
mrh continuous integration #449: Commit 05d0482 pushed by MatthewRHermes
March 26, 2024 21:46 19m 7s dev
dev
March 26, 2024 21:46 19m 7s
Merge branch 'debug_lassis_file' into lassis_lroots_counting
mrh continuous integration #448: Commit ad2335d pushed by MatthewRHermes
March 26, 2024 21:23 19m 41s lassis_ncharge_rationalization
March 26, 2024 21:23 19m 41s
More complete logging in LASSIS
mrh continuous integration #447: Commit 6d13c64 pushed by MatthewRHermes
March 26, 2024 18:15 19m 20s dev
dev
March 26, 2024 18:15 19m 20s
LASSCF RDMSolver dump_chk support.
mrh continuous integration #445: Commit 433b43d pushed by MatthewRHermes
March 25, 2024 17:53 19m 18s dev
dev
March 25, 2024 17:53 19m 18s
Docstrings for *_make_*dm functions of LASSCF.
mrh continuous integration #444: Commit 52dac91 pushed by MatthewRHermes
March 25, 2024 16:23 19m 2s lsa_lasscf
March 25, 2024 16:23 19m 2s
Merge branch 'get_init_guess_ci_bugcheck' into lsa_lasscf
mrh continuous integration #443: Commit 10ffb83 pushed by MatthewRHermes
March 22, 2024 21:40 18m 39s dev
dev
March 22, 2024 21:40 18m 39s
delete comment
mrh continuous integration #442: Commit 28d1463 pushed by MatthewRHermes
March 22, 2024 21:20 19m 20s lsa_lasscf
March 22, 2024 21:20 19m 20s
refactor las get_init_guess_ci
mrh continuous integration #441: Commit 4990503 pushed by MatthewRHermes
March 22, 2024 20:48 18m 49s lsa_lasscf
March 22, 2024 20:48 18m 49s
lroots and lweights in lasscf.state_average
mrh continuous integration #440: Commit 9656f61 pushed by MatthewRHermes
March 22, 2024 00:41 3m 5s lsa_lasscf
March 22, 2024 00:41 3m 5s
Merge pull request #76 from cjknight/gpudev
mrh continuous integration #439: Commit 654d614 pushed by MatthewRHermes
March 21, 2024 22:47 19m 22s gpu
gpu
March 21, 2024 22:47 19m 22s
Merge branch 'issue34_laslayer' into issue34
mrh continuous integration #438: Commit b56e5dd pushed by MatthewRHermes
March 21, 2024 22:43 1m 8s dev
dev
March 21, 2024 22:43 1m 8s
GPU update
mrh continuous integration #437: Pull request #76 opened by cjknight
March 21, 2024 22:12 18m 54s cjknight:gpudev
March 21, 2024 22:12 18m 54s
Merge branch 'issue34_laslayer' into issue34
mrh continuous integration #436: Commit b56e5dd pushed by MatthewRHermes
March 21, 2024 19:51 19m 1s issue34
March 21, 2024 19:51 19m 1s
h1e zip fcisolver nroots loop behavior (#34)
mrh continuous integration #435: Commit 03f3f24 pushed by MatthewRHermes
March 20, 2024 19:00 19m 2s issue34
March 20, 2024 19:00 19m 2s
Merge pull request #74 from JangidBhavnesh/master
mrh continuous integration #434: Commit 0fae0da pushed by MatthewRHermes
March 20, 2024 17:12 19m 1s dev
dev
March 20, 2024 17:12 19m 1s
LASSI-PDFT updated the framework & example
mrh continuous integration #433: Pull request #74 synchronize by JangidBhavnesh
March 20, 2024 16:30 19m 17s master
March 20, 2024 16:30 19m 17s
PySCF compatibility check
mrh continuous integration #432: Commit 3dab0fa pushed by MatthewRHermes
March 18, 2024 17:17 18m 28s dev
dev
March 18, 2024 17:17 18m 28s
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