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RT-TDDFT GPU Acceleration: RT-TD now fully support GPU computation (#… Container #102: Commit 3f8fe4f pushed by A-006
3s develop
develop
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Add memory functions using abacusDevice_t (#5861) Container #101: Commit 76d023b pushed by A-006
3s develop
develop
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Remove TensorMap after cg call (#5797) Container #100: Commit a2ec5d1 pushed by A-006
3s develop
develop
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Refactor:remove MPI part funcs of ucell (#5810) Container #99: Commit 464c7a1 pushed by A-006
3s develop
develop
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Move force/stress precalc functions into new files and remove the glo… Container #98: Commit 8407ee9 pushed by A-006
2s develop
develop
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add const in module_lr (#5817) Container #97: Commit 706633f pushed by A-006
2s develop
develop
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[Feature] Add some GPU kernels to blas_connector (#5799) Container #96: Commit 9ab9150 pushed by A-006
2s develop
develop
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Refactor:remove cal_tau from ElecStateLCAO (#5802) Container #95: Commit 414446a pushed by A-006
2s develop
develop
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fix some warnings about esolver (#5807) Container #94: Commit 028e91d pushed by A-006
2s develop
develop
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Fix: instable nonlocal pp in uspp (#5798) Container #93: Commit 7d14803 pushed by A-006
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develop
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Refactor:Remove update_tau_pos in ucell (#5783) Container #92: Commit c53f445 pushed by A-006
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develop
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Refactor: Remove global dependence of some functions in DeePKS. (#5778) Container #91: Commit 9bf2533 pushed by A-006
2s develop
develop
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Feature: LR-TDDFT absorption spectrum in velocity gauge (#5760) Container #90: Commit 0cdab49 pushed by A-006
2s develop
develop
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Refactor: split pseudopot_cell_vl and pseudopot_cell_vnl (#5743) Container #89: Commit 38cef80 pushed by A-006
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Refactor: remove GlobalC::solvent_model (#5735) Container #88: Commit c1cb6ac pushed by A-006
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update bfgs_trad method (#5662) Container #87: Commit c099d03 pushed by A-006
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develop
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Refactor: remove GlobalC::GridD (#5720) Container #86: Commit 1f9779d pushed by A-006
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Docs: Gitee repo info and toolchain info update (#5666) Container #85: Commit ea3a0dd pushed by A-006
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Update Wannier90 interface document. (#5714) Container #84: Commit 5280bd4 pushed by A-006
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Refactor: add smooth threshold support for david method (#5697) Container #83: Commit fd3a6d8 pushed by A-006
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develop
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Fix: initialize values in module_relax/relax_new (#5696) Container #82: Commit fe7c74a pushed by A-006
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Fix: init_mixing before beforescf (#5683) Container #81: Commit ce1fecf pushed by A-006
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develop
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Refactor:Remove GlobalC::ucell in module_pwdft (#5658) Container #80: Commit 3b1fa6e pushed by A-006
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Refactor: remove GlobalC::Grid_D in hamilt_lcao (#5664) Container #79: Commit a363fdf pushed by A-006
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format wf_atomic files (#5653) Container #78: Commit 5f1b128 pushed by A-006
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