From e9470cc61f949facc54c86912c5a6a9ced289c53 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?=E9=AB=98=E6=96=87=E5=B0=A7?= <18848977154@163.com> Date: Thu, 19 Jun 2025 11:38:36 +0800 Subject: [PATCH] qe --- templates/qe/6.4/data.qe.arm.cpu.config | 17 +++++++++++------ 1 file changed, 11 insertions(+), 6 deletions(-) diff --git a/templates/qe/6.4/data.qe.arm.cpu.config b/templates/qe/6.4/data.qe.arm.cpu.config index feb88c8..9505f50 100644 --- a/templates/qe/6.4/data.qe.arm.cpu.config +++ b/templates/qe/6.4/data.qe.arm.cpu.config @@ -7,17 +7,21 @@ qe/6.4 $JARVIS_PROXY/QEF/q-e/archive/refs/tags/qe-6.4.1.tar.gz q-e-qe-6.4.1.tar. [DEPENDENCY] set -x set -e -./jarvis -install bisheng/2.1.0 com module purge +./jarvis -install bisheng/2.1.0 com module use ./software/modulefiles module load bisheng/2.1.0 export CC=`which clang` export CXX=`which clang++` export FC=`which flang` ./jarvis -install hmpi/1.1.1 bisheng +module use ./software/moduledeps/bisheng2.1.0 module load hmpi/1.1.1 -./jarvis -bench mpi +export CC=`which clang` +export CXX=`which clang++` +export FC=`which flang` ./jarvis -install openblas/0.3.18 bisheng +module load openblas/0.3.18 cd tmp/ tar -xzvf ${JARVIS_DOWNLOAD}/q-e-qe-6.4.1.tar.gz @@ -29,6 +33,7 @@ module load bisheng/2.1.0 export CC=`which clang` export CXX=`which clang++` export FC=`which flang` +module use ./software/moduledeps/bisheng2.1.0 module load hmpi/1.1.1 module load openblas/0.3.18 export BLAS_LIBS="-L${JARVIS_LIBS}/bisheng2.1.0/openblas/0.3.18/lib -lopenblas" @@ -37,8 +42,8 @@ export LAPACK_LIBS="-L${JARVIS_LIBS}/bisheng2.1.0/openblas/0.3.18/lib -lopenblas [APP] app_name = QE build_dir = ${JARVIS_ROOT}/tmp/q-e-qe-6.4.1 -binary_dir = -case_dir = +binary_dir = +case_dir = [BUILD] ./configure --prefix=${JARVIS_ROOT}/software/apps/QE F90=flang F77=flang MPIF90=mpifort MPIF77=mpifort CC=mpicc FCFLAGS="-O3" CFLAGS="-O3" --with-scalapack=no --enable-openmp @@ -49,6 +54,6 @@ make install make clean [RUN] -run = -binary = +run = +binary = nodes = 1 -- Gitee