From e424db34acbd2b58c8c77aadab1b165c542ad9e0 Mon Sep 17 00:00:00 2001 From: wenfei-li Date: Wed, 15 Nov 2023 16:58:20 +0800 Subject: [PATCH 1/2] update version of libpaw --- deps/libpaw_interface | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/deps/libpaw_interface b/deps/libpaw_interface index 60c445a0f99..2ddf912ed2b 160000 --- a/deps/libpaw_interface +++ b/deps/libpaw_interface @@ -1 +1 @@ -Subproject commit 60c445a0f994151ecdea14d942690943340125be +Subproject commit 2ddf912ed2b59bec8865df81c00d18d450c8b32f From 7e9f82cc6fb89d68c2afd9dc3998c83d50de8ab3 Mon Sep 17 00:00:00 2001 From: wenfei-li Date: Thu, 16 Nov 2023 14:29:24 +0800 Subject: [PATCH 2/2] Fix : paw bug when compiled serial --- source/module_esolver/esolver_ks.cpp | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/source/module_esolver/esolver_ks.cpp b/source/module_esolver/esolver_ks.cpp index b45420cdd90..52351b38b71 100644 --- a/source/module_esolver/esolver_ks.cpp +++ b/source/module_esolver/esolver_ks.cpp @@ -261,7 +261,7 @@ namespace ModuleESolver } } #else - this->get_rhoijp(rhoijp, rhoijselect, nrhoijsel); + GlobalC::paw_cell.get_rhoijp(rhoijp, rhoijselect, nrhoijsel); for(int iat = 0; iat < GlobalC::ucell.nat; iat ++) {