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Add poisson-boltzmann to the SCRF
Build and test MRChem #681: Pull request #450 synchronize by Gabrielgerez
February 8, 2024 10:16 10m 10s Gabrielgerez:pb-solvation
February 8, 2024 10:16 10m 10s
correct numAtoms in xyz writer
Build and test MRChem #680: Commit b94438c pushed by stigrj
February 6, 2024 12:25 21m 1s master
February 6, 2024 12:25 21m 1s
Add poisson-boltzmann to the SCRF
Build and test MRChem #679: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 11:57 13m 41s Gabrielgerez:pb-solvation
February 6, 2024 11:57 13m 41s
Add poisson-boltzmann to the SCRF
Build and test MRChem #678: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 10:51 12m 8s Gabrielgerez:pb-solvation
February 6, 2024 10:51 12m 8s
Add poisson-boltzmann to the SCRF
Build and test MRChem #677: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 10:13 12m 5s Gabrielgerez:pb-solvation
February 6, 2024 10:13 12m 5s
Feature/relax
Build and test MRChem #676: Pull request #451 synchronize by moritzgubler
February 6, 2024 09:45 14m 33s moritzgubler:feature/relax
February 6, 2024 09:45 14m 33s
Merge pull request #479 from MRChemSoft/fix-476
Build and test MRChem #675: Commit 4b6acfe pushed by Gabrielgerez
February 6, 2024 09:42 20m 47s master
February 6, 2024 09:42 20m 47s
Add poisson-boltzmann to the SCRF
Build and test MRChem #674: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 09:26 24m 7s Gabrielgerez:pb-solvation
February 6, 2024 09:26 24m 7s
Add poisson-boltzmann to the SCRF
Build and test MRChem #673: Pull request #450 synchronize by robertodr
February 6, 2024 09:02 12m 20s Gabrielgerez:pb-solvation
February 6, 2024 09:02 12m 20s
Only validate cavity when doing PCM
Build and test MRChem #672: Pull request #479 opened by robertodr
February 6, 2024 08:57 11m 55s fix-476
February 6, 2024 08:57 11m 55s
Add poisson-boltzmann to the SCRF
Build and test MRChem #670: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 08:06 14m 0s Gabrielgerez:pb-solvation
February 6, 2024 08:06 14m 0s
Add poisson-boltzmann to the SCRF
Build and test MRChem #669: Pull request #450 synchronize by Gabrielgerez
February 6, 2024 07:38 17m 1s Gabrielgerez:pb-solvation
February 6, 2024 07:38 17m 1s
Add poisson-boltzmann to the SCRF
Build and test MRChem #668: Pull request #450 synchronize by Gabrielgerez
February 5, 2024 17:31 28m 18s Gabrielgerez:pb-solvation
February 5, 2024 17:31 28m 18s
Add poisson-boltzmann to the SCRF
Build and test MRChem #667: Pull request #450 synchronize by Gabrielgerez
February 5, 2024 17:08 16m 26s Gabrielgerez:pb-solvation
February 5, 2024 17:08 16m 26s
Add poisson-boltzmann to the SCRF
Build and test MRChem #666: Pull request #450 synchronize by Gabrielgerez
February 5, 2024 16:45 12m 4s Gabrielgerez:pb-solvation
February 5, 2024 16:45 12m 4s
Add poisson-boltzmann to the SCRF
Build and test MRChem #665: Pull request #450 synchronize by Gabrielgerez
February 5, 2024 16:26 12m 19s Gabrielgerez:pb-solvation
February 5, 2024 16:26 12m 19s
Feature/relax
Build and test MRChem #664: Pull request #451 synchronize by moritzgubler
February 5, 2024 08:35 11m 50s moritzgubler:feature/relax
February 5, 2024 08:35 11m 50s
Feature/relax
Build and test MRChem #663: Pull request #451 synchronize by moritzgubler
February 2, 2024 14:35 21m 19s moritzgubler:feature/relax
February 2, 2024 14:35 21m 19s
Feature/relax
Build and test MRChem #660: Pull request #451 synchronize by moritzgubler
February 1, 2024 16:51 23m 44s moritzgubler:feature/relax
February 1, 2024 16:51 23m 44s
Feature/relax
Build and test MRChem #659: Pull request #451 synchronize by moritzgubler
February 1, 2024 16:22 19m 5s moritzgubler:feature/relax
February 1, 2024 16:22 19m 5s
Node based DFT
Build and test MRChem #657: Pull request #475 synchronize by gitpeterwind
January 31, 2024 13:57 1m 34s gitpeterwind:node_xc
January 31, 2024 13:57 1m 34s
Node based DFT
Build and test MRChem #656: Pull request #475 synchronize by gitpeterwind
January 30, 2024 14:18 1m 47s gitpeterwind:node_xc
January 30, 2024 14:18 1m 47s
Render programmers' manual in docs
Build and test MRChem #655: Pull request #469 synchronize by ilfreddy
January 23, 2024 12:30 23m 7s programmers-docs
January 23, 2024 12:30 23m 7s