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Fix shape mismatch of bond_list in model_system Testing with coveralls Report #153: Commit 7d7d08a pushed by Bernadette-Mohr
November 1, 2024 14:44 1m 14s fix-bond-list
fix-bond-list
November 1, 2024 14:44 1m 14s
move GTOIntegralDecomposition to NumericalSettings Testing with coveralls Report #152: Commit 62de243 pushed by EBB2675
November 1, 2024 14:14 1m 17s test-branch
test-branch
November 1, 2024 14:14 1m 17s
Fix shape mismatch of bond_list in model_system Testing with coveralls Report #151: Commit 0dd2cee pushed by Bernadette-Mohr
November 1, 2024 13:59 1m 8s fix-bond-list
fix-bond-list
November 1, 2024 13:59 1m 8s
test push Testing with coveralls Report #150: Commit caf6c6b pushed by JFRudzinski
October 29, 2024 09:46 1m 7s test_push
test_push
October 29, 2024 09:46 1m 7s
move GTOIntegralDecomposition to NumericalSettings Testing with coveralls Report #149: Commit 62de243 pushed by EBB2675
October 24, 2024 15:03 1m 6s 130-atom-centered-basis-set
130-atom-centered-basis-set
October 24, 2024 15:03 1m 6s
merge develop Testing with coveralls Report #148: Commit a007e1e pushed by EBB2675
October 18, 2024 10:20 1m 5s 130-atom-centered-basis-set
130-atom-centered-basis-set
October 18, 2024 10:20 1m 5s
Converted lattice vectors to Nomad-compatible matrix format. Testing with coveralls Report #147: Commit ed21371 pushed by Bernadette-Mohr
October 16, 2024 16:58 1m 27s cg-particle-support
cg-particle-support
October 16, 2024 16:58 1m 27s
rename IntegralDecomposition to GTOIntegralDecomposition Testing with coveralls Report #146: Commit a0c48e5 pushed by EBB2675
October 16, 2024 14:09 1m 5s ri-approximation
ri-approximation
October 16, 2024 14:09 1m 5s
restructure RI, add IntegralDecomposition class Testing with coveralls Report #145: Commit 7bb24f8 pushed by EBB2675
October 16, 2024 13:04 1m 17s ri-approximation
ri-approximation
October 16, 2024 13:04 1m 17s
Add error raising to BaseElectronicEigenvalues.n_bands Testing with coveralls Report #144: Commit b776565 pushed by ndaelman-hu
October 16, 2024 13:03 1m 19s 143-physicalproperty-rank-checks-broken
143-physicalproperty-rank-checks-broken
October 16, 2024 13:03 1m 19s
Remove check for n_ quantities Testing with coveralls Report #143: Commit dec63f6 pushed by ndaelman-hu
October 16, 2024 12:48 1m 3s 143-physicalproperty-rank-checks-broken
143-physicalproperty-rank-checks-broken
October 16, 2024 12:48 1m 3s
Extend equalities with comparison (#122) Testing with coveralls Report #142: Commit 20d2fb2 pushed by ndaelman-hu
October 16, 2024 12:36 1m 2s develop
develop
October 16, 2024 12:36 1m 2s
cosx has its own grid Testing with coveralls Report #141: Commit d341853 pushed by EBB2675
October 16, 2024 12:05 1m 4s ri-approximation
ri-approximation
October 16, 2024 12:05 1m 4s
add a placeholder for COSX Testing with coveralls Report #140: Commit bc155be pushed by EBB2675
October 16, 2024 11:55 1m 6s ri-approximation
ri-approximation
October 16, 2024 11:55 1m 6s
add a draft ResolutionOfIdentity to NumericalSettings Testing with coveralls Report #139: Commit 806a733 pushed by EBB2675
October 16, 2024 11:46 1m 11s ri-approximation
ri-approximation
October 16, 2024 11:46 1m 11s
Add some methods for the cell (#140) Testing with coveralls Report #138: Commit 8b360d2 pushed by EBB2675
October 16, 2024 09:11 1m 10s ri-approximation
ri-approximation
October 16, 2024 09:11 1m 10s
Reinsert get_chemical_symbols Testing with coveralls Report #137: Commit 4887cb4 pushed by ndaelman-hu
October 15, 2024 12:13 1m 5s extend_equalities
extend_equalities
October 15, 2024 12:13 1m 5s
Move _check_implemented outside of PartialOrderElement Testing with coveralls Report #136: Commit ad29fa0 pushed by ndaelman-hu
October 15, 2024 11:52 1m 4s extend_equalities
extend_equalities
October 15, 2024 11:52 1m 4s
working on CG schema Testing with coveralls Report #135: Commit 9508fd9 pushed by Bernadette-Mohr
October 14, 2024 15:47 55s cg-particle-support
cg-particle-support
October 14, 2024 15:47 55s
a bit of a cleanup Testing with coveralls Report #134: Commit c94e995 pushed by EBB2675
October 14, 2024 09:08 1m 1s 130-atom-centered-basis-set
130-atom-centered-basis-set
October 14, 2024 09:08 1m 1s
working on CG schema Testing with coveralls Report #133: Commit beb7a8b pushed by Bernadette-Mohr
October 11, 2024 13:28 1m 4s cg-particle-support
cg-particle-support
October 11, 2024 13:28 1m 4s
fix point charge Quantity type Testing with coveralls Report #132: Commit 8c6ae1a pushed by EBB2675
October 11, 2024 12:55 1m 1s 130-atom-centered-basis-set
130-atom-centered-basis-set
October 11, 2024 12:55 1m 1s
Add ! comments for asking Alvin Testing with coveralls Report #131: Commit 2d7c4a9 pushed by JosePizarro3
October 10, 2024 10:15 1m 29s 100-trying-restructured-workflows
100-trying-restructured-workflows
October 10, 2024 10:15 1m 29s
Fix resolve_inputs_outputs Testing with coveralls Report #130: Commit f337b73 pushed by JosePizarro3
October 10, 2024 10:10 1m 32s 100-trying-restructured-workflows
100-trying-restructured-workflows
October 10, 2024 10:10 1m 32s
Improved schema with new workflow base sections Testing with coveralls Report #129: Commit 7f46488 pushed by JosePizarro3
October 10, 2024 10:03 1m 34s 100-trying-restructured-workflows
100-trying-restructured-workflows
October 10, 2024 10:03 1m 34s