v3.9.0

What's Changed

Feature

• Feature: Allow directly compiling CUDA version on DCU harware by @Critsium-xy in deepmodeling#5727
• Feature: add smooth ethr for all iter methods by @haozhihan in deepmodeling#5732
• Feature: enable cal_force and cal_stress in nscf by @YuLiu98 in deepmodeling#5752
• Feature: LR-TDDFT absorption spectrum in velocity gauge by @maki49 in deepmodeling#5760
• update bfgs_trad method by @19hello in deepmodeling#5662

Fix

• Fix: update kinetic energy when all atoms are fixed by @YuLiu98 in deepmodeling#5729
• Fix: Segment Fault of PAW by @Qianruipku in deepmodeling#5738
• Fix: Segment fault in GPU-Davidson by @Qianruipku in deepmodeling#5763
• Fix stru by @dyzheng in deepmodeling#5772
• Fix: enable ecutrho/ecutwfc > 4 for ncpp by @YuLiu98 in deepmodeling#5765

Docs

• Docs: move doxygen to headers for DiagoDavid class and add some new by @Cstandardlib in deepmodeling#5736
• Docs: update the docs of exx_ccp_rmesh_times and exx_real_number by @Chentao168 in deepmodeling#5758

Refactor

• Refactor: add const for Grid_Driver by @YuLiu98 in deepmodeling#5725
• Refactor: Change some functions in module_deepks into template. by @ErjieWu in deepmodeling#5731
• Refactor:remove GlobalC::ucell in module_elesctate by @A-006 in deepmodeling#5730
• Refactor: remove GlobalC::solvent_model by @YuLiu98 in deepmodeling#5735
• Refactor:Remove GlobalC::ucell by @A-006 in deepmodeling#5737
• Refactor: remove GlobalC::Pgrid by @Qianruipku in deepmodeling#5740
• Refactor: split pseudopot_cell_vl and pseudopot_cell_vnl by @YuLiu98 in deepmodeling#5743
• Refactor: refactor neighbour atom search but no change on algo by @goodchong in deepmodeling#5759
• Refactor: remove the Psi Constructors using int* ngk_in by @haozhihan in deepmodeling#5745
• Refactor: Replace nlm_save in DeePKS by HContainer object phialpha. by @ErjieWu in deepmodeling#5766

Full Changelog: v3.8.5...v3.9.0