Release v2.3.4 · abacusmodeling/abacus-develop

Features

Feature: plot different contributions of atomic orbitals in PBANDS by @1041176461 in #174
Feature: add openmp in ORB_table_phi::cal_ST_Phi12_R() by @PeizeLin in #175
Feature: log math lib info by @caic99 in deepmodeling#1172
Feature: build libxc in the absence of local install by @caic99 in deepmodeling#1173
Feature: add force correction for implicit solvation model by @sunml99 in deepmodeling#1174
Performance: Optimize SDFT to use less Chebyshev expansions by @Qianruipku in deepmodeling#1179
Performance: accelerate stochastic DOS by @Qianruipku in deepmodeling#1185
Feature: add dpgen autotest example by @hongriTianqi in deepmodeling#1189

Refactor: fully decouple esolver and relaxation, and build a new module: module_relaxation by @wenfei-li in deepmodeling#1170 and deepmodeling#1186
Refactor: modified Operator::hPsi(), hpsi memory arranged outside by @dyzheng in deepmodeling#1188

Fix: a error of mem_saver=1 with ks_solver=cg has been fixed by @dyzheng in deepmodeling#1168
Fix: fix bug in 2nd order charge extrapolation by @wenfei-li in deepmodeling#1169
Fix: do delete before new tau_original in atom_spec.cpp by @pxlxingliang in deepmodeling#1175
Fix: Veff error when MPI_threads larger than nz by @dyzheng in deepmodeling#1183
Fix: bug in envelop function by @wenfei-li in deepmodeling#1186
Fix: Scan error when MPI_threads larger than nz by @Qianruipku in deepmodeling#1187
Fix: updated key word of total time and replace "-eq" with "==" by @dyzheng in deepmodeling#1190

docs: update input parameters in input-main.md: exx_separate_loop, exx_hybrid_step, exx_lambda by @1041176461 in #174
docs: update libxc keyword in install.md by @PoloTier #178
docs: fix dead links in deepks installation by @caic99 in deepmodeling#1176
docs: update ambiguous phrases by @caic99 in deepmodeling#1178
docs: update gcc requirements by @caic99 in deepmodeling#1180

Full Changelog: v2.3.3...v2.3.4