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use runcontext for ccsd restart ExaChem_Linter #29: Commit 148ca74 pushed by ajaypanyala
November 23, 2024 09:21 1m 17s main
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November 23, 2024 09:21 1m 17s
refactor cholesky module usage, remove force_tilesize option and upda… ExaChem_Linter #28: Commit ad11e69 pushed by ajaypanyala
November 6, 2024 05:05 26s main
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November 6, 2024 05:05 26s
Add output_dir option. ExaChem_Linter #27: Commit 03fda28 pushed by ajaypanyala
October 27, 2024 22:54 24s main
main
October 27, 2024 22:54 24s
initial attempt to enable all methods as a library ExaChem_Linter #26: Commit 69b8228 pushed by ajaypanyala
October 11, 2024 22:07 33s main
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October 11, 2024 22:07 33s
better tiling for the MO spaces ExaChem_Linter #25: Commit d35bd49 pushed by ajaypanyala
October 1, 2024 06:09 21s main
main
October 1, 2024 06:09 21s
initial attempt to use scf as a library ExaChem_Linter #24: Commit 3553cba pushed by ajaypanyala
August 1, 2024 07:44 24s main
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August 1, 2024 07:44 24s
Using GPU rmm pool for CCSD(T) ExaChem_Linter #23: Commit 88d1ada pushed by ajaypanyala
June 17, 2024 21:33 28s main
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June 17, 2024 21:33 28s
[DPLOT] Bug fix ExaChem_Linter #22: Commit f44668b pushed by ajaypanyala
June 12, 2024 04:55 23s main
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June 12, 2024 04:55 23s
update copyright ExaChem_Linter #21: Commit 519edbb pushed by ajaypanyala
May 28, 2024 03:16 29s main
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May 28, 2024 03:16 29s
[SCF] minor cleanup, enable gauxc device execution ExaChem_Linter #20: Commit f33d199 pushed by ajaypanyala
March 28, 2024 22:22 22s main
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March 28, 2024 22:22 22s
[SCF] cleanup restart logic ExaChem_Linter #19: Commit 4d45b71 pushed by ajaypanyala
January 15, 2024 18:22 27s main
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January 15, 2024 18:22 27s
fix default units ExaChem_Linter #18: Commit b34a520 pushed by ajaypanyala
January 9, 2024 21:06 29s main
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January 9, 2024 21:06 29s
[SCF] adjust lshift based on homo-lumo gap, [CI] update reference out… ExaChem_Linter #17: Commit 7751ec0 pushed by ajaypanyala
December 20, 2023 19:53 23s main
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December 20, 2023 19:53 23s
process multiple input files, add freeze atomic option, fix warnings ExaChem_Linter #16: Commit 80a85bb pushed by ajaypanyala
November 6, 2023 21:22 24s main
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November 6, 2023 21:22 24s
[SCF] seperate DF code, cleanup sqrtinv routines ExaChem_Linter #15: Commit 6c28f88 pushed by ajaypanyala
November 1, 2023 19:39 27s main
main
November 1, 2023 19:39 27s
[SCF] seperate DF code, cleanup sqrtinv routines ExaChem_Linter #14: Commit 0f0e13a pushed by ajaypanyala
October 31, 2023 17:44 38s main
main
October 31, 2023 17:44 38s
[SCF] cleanup code, memory allocations, remove old guess ExaChem_Linter #13: Commit ddb9d28 pushed by ajaypanyala
October 28, 2023 02:58 37s main
main
October 28, 2023 02:58 37s