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Fleshed out the Monte Carlo solver
NWChem_CI #199: Commit 02365a0 pushed by hjjvandam
January 1, 2025 22:00 Queued noft1
January 1, 2025 22:00 Queued
Fleshed out the Monte Carlo solver
lint_python #137: Commit 02365a0 pushed by hjjvandam
January 1, 2025 22:00 2m 40s noft1
January 1, 2025 22:00 2m 40s
Add energy evaluation API.
NWChem_CI #198: Commit 486f515 pushed by hjjvandam
January 1, 2025 20:11 1h 56m 42s noft1
January 1, 2025 20:11 1h 56m 42s
Add energy evaluation API.
lint_python #136: Commit 486f515 pushed by hjjvandam
January 1, 2025 20:11 2m 39s noft1
January 1, 2025 20:11 2m 39s
Adding rotation calculation
NWChem_CI #197: Commit ddf9d64 pushed by hjjvandam
January 1, 2025 16:46 2h 3m 40s noft1
January 1, 2025 16:46 2h 3m 40s
Adding rotation calculation
lint_python #135: Commit ddf9d64 pushed by hjjvandam
January 1, 2025 16:46 2m 37s noft1
January 1, 2025 16:46 2m 37s
Adding the Monte Carlo step
NWChem_CI #196: Commit 60e848e pushed by hjjvandam
December 30, 2024 11:56 2h 0m 46s noft1
December 30, 2024 11:56 2h 0m 46s
Adding the Monte Carlo step
lint_python #134: Commit 60e848e pushed by hjjvandam
December 30, 2024 11:56 2m 39s noft1
December 30, 2024 11:56 2m 39s
Adding Monte Carlo range routines.
lint_python #133: Commit bfdfb89 pushed by hjjvandam
December 29, 2024 22:17 2m 39s noft1
December 29, 2024 22:17 2m 39s
Adding Monte Carlo range routines.
NWChem_CI #195: Commit bfdfb89 pushed by hjjvandam
December 29, 2024 22:17 2h 6m 59s noft1
December 29, 2024 22:17 2h 6m 59s
Interface to access local parts of GA like regular arrays
lint_python #132: Commit ad7a076 pushed by hjjvandam
December 29, 2024 20:39 2m 41s noft1
December 29, 2024 20:39 2m 41s
Interface to access local parts of GA like regular arrays
NWChem_CI #194: Commit ad7a076 pushed by hjjvandam
December 29, 2024 20:39 1h 57m 44s noft1
December 29, 2024 20:39 1h 57m 44s
NWChem_CI
NWChem_CI #193: Scheduled
December 29, 2024 00:28 1h 57m 29s master
December 29, 2024 00:28 1h 57m 29s
Adding more Monte Carlo pieces
NWChem_CI #192: Commit fdf05b3 pushed by hjjvandam
December 26, 2024 23:28 1h 59m 32s noft1
December 26, 2024 23:28 1h 59m 32s
Adding more Monte Carlo pieces
lint_python #131: Commit fdf05b3 pushed by hjjvandam
December 26, 2024 23:28 2m 39s noft1
December 26, 2024 23:28 2m 39s
Adding loading Monte Carlo parameters
lint_python #130: Commit 48da8eb pushed by hjjvandam
December 26, 2024 20:39 2m 39s noft1
December 26, 2024 20:39 2m 39s
Adding loading Monte Carlo parameters
NWChem_CI #191: Commit 48da8eb pushed by hjjvandam
December 26, 2024 20:39 1h 53m 21s noft1
December 26, 2024 20:39 1h 53m 21s
Additions for Monte Carlo solver
NWChem_CI #190: Commit 1171b48 pushed by hjjvandam
December 26, 2024 12:32 2h 0m 26s noft1
December 26, 2024 12:32 2h 0m 26s
Additions for Monte Carlo solver
lint_python #129: Commit 1171b48 pushed by hjjvandam
December 26, 2024 12:32 2m 37s noft1
December 26, 2024 12:32 2m 37s
Results from the Monte Carlo optimizer.
lint_python #128: Commit 669751c pushed by hjjvandam
December 23, 2024 21:05 2m 36s noft1
December 23, 2024 21:05 2m 36s
Results from the Monte Carlo optimizer.
NWChem_CI #189: Commit 669751c pushed by hjjvandam
December 23, 2024 21:05 1h 59m 3s noft1
December 23, 2024 21:05 1h 59m 3s
Monte Carlo optimizer.
NWChem_CI #188: Commit 83acc82 pushed by hjjvandam
December 22, 2024 22:54 1h 58m 28s noft1
December 22, 2024 22:54 1h 58m 28s
Monte Carlo optimizer.
lint_python #127: Commit 83acc82 pushed by hjjvandam
December 22, 2024 22:54 2m 35s noft1
December 22, 2024 22:54 2m 35s
NWChem_CI
NWChem_CI #187: Scheduled
December 22, 2024 00:28 1h 58m 23s master
December 22, 2024 00:28 1h 58m 23s
NWChem_CI
NWChem_CI #186: Scheduled
December 15, 2024 00:30 2h 1m 48s master
December 15, 2024 00:30 2h 1m 48s