From 3ccd0f02c2ca9fac26fc7eb52af6d654ec9fed27 Mon Sep 17 00:00:00 2001 From: chenshaoheng Date: Sun, 28 Sep 2025 07:25:32 +0000 Subject: [PATCH] =?UTF-8?q?update=20templates/psi4/1.3.2/data.psi4-common.?= =?UTF-8?q?arm.cpu.config.=20pip=E6=B8=85=E5=8D=8E=E6=BA=90=E7=9A=84?= =?UTF-8?q?=E9=83=A8=E5=88=86=E9=93=BE=E6=8E=A5=E5=A4=B1=E6=95=88=EF=BC=8C?= =?UTF-8?q?=E6=9B=B4=E6=8D=A2=E4=B8=BAhauweicloud=E6=AD=A3=E5=B8=B8?= MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit Signed-off-by: chenshaoheng --- templates/psi4/1.3.2/data.psi4-common.arm.cpu.config | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/templates/psi4/1.3.2/data.psi4-common.arm.cpu.config b/templates/psi4/1.3.2/data.psi4-common.arm.cpu.config index c5fefdd..23c4eec 100644 --- a/templates/psi4/1.3.2/data.psi4-common.arm.cpu.config +++ b/templates/psi4/1.3.2/data.psi4-common.arm.cpu.config @@ -59,7 +59,8 @@ case_dir = $JARVIS_ROOT/software/apps/gcc12.3.1/psi4/share/psi4/samples/opt-mult [BUILD] set -x cd ${JARVIS_TMP} -pip3 install pint pydantic==1.10.7 deepdiff==6.3.0 -i https://pypi.mirrors.ustc.edu.cn/simple +pip3 install pint pydantic==1.10.7 -i https://pypi.mirrors.ustc.edu.cn/simple +pip3 install deepdiff==6.3.0 qcelemental==0.29.0 -i https://mirrors.huaweicloud.com/repository/pypi/simple rm psi4-1.3.2 -rf tar -xvf ${JARVIS_DOWNLOAD}/v1.3.2.tar.gz cd psi4-1.3.2 -- Gitee