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cleanup vscode settings
Lint #215: Pull request #4 opened by wenyan4work
February 16, 2024 20:06 17s wy/devops
February 16, 2024 20:06 17s
cleanup vscode settings
self hosted CI #16: Pull request #4 opened by wenyan4work
February 16, 2024 20:06 21m 37s wy/devops
February 16, 2024 20:06 21m 37s
cleanup vscode settings
.github/workflows/github_actions.yml #203: Commit 7f85fce pushed by wenyan4work
February 16, 2024 20:05 Failure wy/devops
February 16, 2024 20:05 Failure
cleanup vscode settings
Lint #214: Commit 7f85fce pushed by wenyan4work
February 16, 2024 20:05 21s wy/devops
February 16, 2024 20:05 21s
add torsionscan example
Lint #213: Commit 7740adb pushed by wenyan4work
February 16, 2024 18:54 20s wy/torsionscan
February 16, 2024 18:54 20s
add torsionscan example
.github/workflows/github_actions.yml #202: Commit 7740adb pushed by wenyan4work
February 16, 2024 18:54 Failure wy/torsionscan
February 16, 2024 18:54 Failure
reduced memory footprint in vxc_deriv1 and vxc_deriv2
Lint #212: Commit 0857af9 pushed by wxj6000
February 16, 2024 00:57 16s hess_nuc_elec
February 16, 2024 00:57 16s
reduced memory footprint in vxc_deriv1 and vxc_deriv2
.github/workflows/github_actions.yml #201: Commit 0857af9 pushed by wxj6000
February 16, 2024 00:57 Failure hess_nuc_elec
February 16, 2024 00:57 Failure
Merge branch 'hess_nuc_elec' of https://github.com/bytedance/gpu4pysc…
.github/workflows/github_actions.yml #200: Commit c7dd975 pushed by wxj6000
February 15, 2024 21:22 Failure hess_nuc_elec
February 15, 2024 21:22 Failure
Merge branch 'master' into hess_nuc_elec
Lint #210: Commit ce3613c pushed by wxj6000
February 15, 2024 20:47 16s hess_nuc_elec
February 15, 2024 20:47 16s
Merge branch 'master' into hess_nuc_elec
.github/workflows/github_actions.yml #199: Commit ce3613c pushed by wxj6000
February 15, 2024 20:47 Failure hess_nuc_elec
February 15, 2024 20:47 Failure
calculate hess_nuc_elec on GPU
Lint #209: Commit ebdf406 pushed by wxj6000
February 15, 2024 20:44 17s hess_nuc_elec
February 15, 2024 20:44 17s
calculate hess_nuc_elec on GPU
.github/workflows/github_actions.yml #198: Commit ebdf406 pushed by wxj6000
February 15, 2024 20:43 Failure hess_nuc_elec
February 15, 2024 20:43 Failure
fix CI fail
Lint #208: Commit b54247e pushed by Miroier
February 8, 2024 11:22 16s dft_grouped_gemm
February 8, 2024 11:22 16s
fix CI fail
.github/workflows/github_actions.yml #197: Commit b54247e pushed by Miroier
February 8, 2024 11:22 Failure dft_grouped_gemm
February 8, 2024 11:22 Failure
fixed unit tests
.github/workflows/github_actions.yml #196: Commit 56b39cf pushed by wxj6000
February 8, 2024 08:15 Failure conv_tol_cpscf
February 8, 2024 08:15 Failure
fixed unit tests
Lint #207: Commit 56b39cf pushed by wxj6000
February 8, 2024 08:15 15s conv_tol_cpscf
February 8, 2024 08:15 15s
mispell e_disp
.github/workflows/github_actions.yml #195: Commit 588f72f pushed by wxj6000
February 8, 2024 06:42 Failure conv_tol_cpscf
February 8, 2024 06:42 Failure
mispell e_disp
Lint #206: Commit 588f72f pushed by wxj6000
February 8, 2024 06:42 15s conv_tol_cpscf
February 8, 2024 06:42 15s
conv_tol_cpscf = 1e-3 by default
Lint #205: Commit ce5f382 pushed by wxj6000
February 8, 2024 06:35 19s conv_tol_cpscf
February 8, 2024 06:35 19s
conv_tol_cpscf = 1e-3 by default
.github/workflows/github_actions.yml #194: Commit ce5f382 pushed by wxj6000
February 8, 2024 06:35 Failure conv_tol_cpscf
February 8, 2024 06:35 Failure
solvent model for uhf, with_lapl=False (#102)
self hosted CI #15: Commit 212fa37 pushed by wxj6000
February 7, 2024 18:41 18m 3s master
February 7, 2024 18:41 18m 3s
solvent model for uhf, with_lapl=False (#102)
.github/workflows/github_actions.yml #193: Commit 212fa37 pushed by wxj6000
February 7, 2024 18:41 Failure master
February 7, 2024 18:41 Failure
solvent model for uhf, with_lapl=False (#102)
Lint #204: Commit 212fa37 pushed by wxj6000
February 7, 2024 18:41 20s master
February 7, 2024 18:41 20s