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Perf: change default pw_seed=0
Pyabacus Build and Test #3590: Pull request #5179 synchronize by WHUweiqingzhou
September 27, 2024 03:30 2m 23s WHUweiqingzhou:pw_seed
September 27, 2024 03:30 2m 23s
Perf: change default pw_seed=0
Pyabacus Build and Test #3589: Pull request #5179 synchronize by WHUweiqingzhou
September 27, 2024 03:18 2m 22s WHUweiqingzhou:pw_seed
September 27, 2024 03:18 2m 22s
Perf: change default pw_seed=0
Pyabacus Build and Test #3588: Pull request #5179 synchronize by WHUweiqingzhou
September 27, 2024 02:40 2m 17s WHUweiqingzhou:pw_seed
September 27, 2024 02:40 2m 17s
Feature: Calculate and output electron localization function (ELF) with KSDFT and OFDFT
Pyabacus Build and Test #3587: Pull request #5139 synchronize by sunliang98
September 26, 2024 06:44 2m 22s sunliang98:elf
September 26, 2024 06:44 2m 22s
Perf: optimize td_current
Pyabacus Build and Test #3586: Pull request #5181 synchronize by dzzz2001
September 26, 2024 06:32 6m 1s dzzz2001:tddft
September 26, 2024 06:32 6m 1s
Perf: optimize td_current
Pyabacus Build and Test #3585: Pull request #5181 opened by dzzz2001
September 26, 2024 06:32 2m 20s dzzz2001:tddft
September 26, 2024 06:32 2m 20s
Perf: change default pw_seed=0
Pyabacus Build and Test #3584: Pull request #5179 opened by WHUweiqingzhou
September 26, 2024 05:56 2m 15s WHUweiqingzhou:pw_seed
September 26, 2024 05:56 2m 15s
Feature: Calculate and output electron localization function (ELF) with KSDFT and OFDFT
Pyabacus Build and Test #3583: Pull request #5139 synchronize by sunliang98
September 26, 2024 05:22 2m 15s sunliang98:elf
September 26, 2024 05:22 2m 15s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3582: Pull request #5140 synchronize by AsTonyshment
September 26, 2024 04:27 2m 21s AsTonyshment:pchg_wf_param
September 26, 2024 04:27 2m 21s
Fix: recover the wannier90 interface for lcao_in_pw case
Pyabacus Build and Test #3581: Pull request #5177 synchronize by kirk0830
September 26, 2024 04:06 10m 27s kirk0830:fix-wannier90-1
September 26, 2024 04:06 10m 27s
Fix: recover the wannier90 interface for lcao_in_pw case
Pyabacus Build and Test #3580: Pull request #5177 opened by kirk0830
September 26, 2024 04:06 6m 2s kirk0830:fix-wannier90-1
September 26, 2024 04:06 6m 2s
Fix: Update function calls in pyabacus to align with new function signature in hpsi_func
Pyabacus Build and Test #3579: Pull request #5176 opened by a1henu
September 26, 2024 02:33 2m 14s a1henu:develop
September 26, 2024 02:33 2m 14s
Radial quadrature grid
Pyabacus Build and Test #3578: Pull request #5173 opened by jinzx10
September 25, 2024 16:36 2m 2s jinzx10:radial_grid
September 25, 2024 16:36 2m 2s
Feature: Calculate and output electron localization function (ELF) with KSDFT and OFDFT
Pyabacus Build and Test #3577: Pull request #5139 synchronize by sunliang98
September 25, 2024 16:09 1m 58s sunliang98:elf
September 25, 2024 16:09 1m 58s
Fix: timer not closed in TDDFT code
Pyabacus Build and Test #3576: Pull request #5172 opened by AsTonyshment
September 25, 2024 12:28 1m 47s AsTonyshment:fix_timer_evolve_psi
September 25, 2024 12:28 1m 47s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3575: Pull request #5140 synchronize by AsTonyshment
September 25, 2024 08:31 34m 3s AsTonyshment:pchg_wf_param
September 25, 2024 08:31 34m 3s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3574: Pull request #5140 synchronize by AsTonyshment
September 25, 2024 08:27 38m 2s AsTonyshment:pchg_wf_param
September 25, 2024 08:27 38m 2s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3573: Pull request #5140 synchronize by AsTonyshment
September 25, 2024 08:24 4m 54s AsTonyshment:pchg_wf_param
September 25, 2024 08:24 4m 54s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3572: Pull request #5140 synchronize by AsTonyshment
September 24, 2024 20:48 1m 44s AsTonyshment:pchg_wf_param
September 24, 2024 20:48 1m 44s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3571: Pull request #5140 synchronize by AsTonyshment
September 24, 2024 20:44 1m 50s AsTonyshment:pchg_wf_param
September 24, 2024 20:44 1m 50s
Feature: Support outputting real space wave functions in Gaussian CUBE format
Pyabacus Build and Test #3570: Pull request #5140 synchronize by AsTonyshment
September 24, 2024 20:38 1m 53s AsTonyshment:pchg_wf_param
September 24, 2024 20:38 1m 53s
Feature: Calculate and output electron localization function (ELF) with KSDFT and OFDFT
Pyabacus Build and Test #3569: Pull request #5139 synchronize by sunliang98
September 24, 2024 15:45 1m 54s sunliang98:elf
September 24, 2024 15:45 1m 54s
Fix: init_chg wfc support npsin = 4
Pyabacus Build and Test #3568: Pull request #5166 synchronize by Qianruipku
September 24, 2024 12:18 2m 10s Qianruipku:develop
September 24, 2024 12:18 2m 10s
Feature: Calculate and output electron localization function (ELF) with KSDFT and OFDFT
Pyabacus Build and Test #3567: Pull request #5139 synchronize by mohanchen
September 24, 2024 11:54 6m 5s sunliang98:elf
September 24, 2024 11:54 6m 5s
Fix: bug of cal_ux
Pyabacus Build and Test #3566: Pull request #5165 synchronize by Qianruipku
September 24, 2024 09:39 1m 57s Qianruipku:hotfix
September 24, 2024 09:39 1m 57s