<div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">Hi, all</div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;"><br /></div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">I am new to LINUX and CP2K. I tried to get the code using the command:</div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">git clone -b support/v2023.1 --recursive https://github.com/cp2k/cp2k.git cp2k</div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;"><br /></div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">then I tried to make the code using the command:</div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">make -j 8 ARCH=Linux-intel-x86_64 VERSION=psmp<br /></div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;"><br /></div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;">but errors appeared:</div><div style="line-height: 1.5; color: rgb(0, 0, 0); font-family: Verdana;"><br /></div>Resolving dependencies ... <br />/usr/bin/env python3 /home/jibiaoli/codes/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine.F90<br />mpiifort -c -O2 -fopenmp -fp-model precise -funroll-loops -g -qopenmp-simd -traceback -xHost -I/home/jibiaoli/codes/cp2k/tools/toolchain/install/libxc-6.0.0/include -I/home/jibiaoli/codes/cp2k/tools/toolchain/install/libxsmm-1.17/include -D__parallel -D__SCALAPACK -D__MKL -D__FFTW3 -D__LIBXSMM -D__MAX_CONTR=4 -D__LIBXC -D__LIBXSMM -I/home/jibiaoli/intel/oneapi/mkl/2022.1.0/include -I/home/jibiaoli/intel/oneapi/mkl/2022.1.0/include/fftw -diag-disable=8291 -diag-disable=8293 -fpp -free -D__SHORT_FILE__="\"dbcsr_machine.F\"" -I'/home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/' -I'/home/jibiaoli/codes/cp2k/exts/dbcsr/src' dbcsr_machine.F90 <br />/home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/dbcsr_machine.F(62): error #7002: Error in opening the compiled module file.  Check INCLUDE paths.   [LIBXSMM]<br />      USE libxsmm, ONLY: libxsmm_timer_tick, libxsmm_timer_duration<br />----------^<br />/home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/dbcsr_machine.F(67): error #6406: Conflicting attributes or multiple declaration of name.   [LIBXSMM_TIMER_DURATION]<br />      wt = libxsmm_timer_duration(0_int_8, libxsmm_timer_tick())<br />-----------^<br />/home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/dbcsr_machine.F(62): error #6580: Name in only-list does not exist or is not accessible.   [LIBXSMM_TIMER_TICK]<br />      USE libxsmm, ONLY: libxsmm_timer_tick, libxsmm_timer_duration<br />-------------------------^<br />/home/jibiaoli/codes/cp2k/exts/dbcsr/src/base/dbcsr_machine.F(62): error #6580: Name in only-list does not exist or is not accessible.   [LIBXSMM_TIMER_DURATION]<br />      USE libxsmm, ONLY: libxsmm_timer_tick, libxsmm_timer_duration<br />---------------------------------------------^<br />compilation aborted for dbcsr_machine.F90 (code 1)<br />make[4]: *** [/home/jibiaoli/codes/cp2k/exts/build_dbcsr//Makefile:258: dbcsr_machine.o] Error 1<br />make[3]: *** [/home/jibiaoli/codes/cp2k/exts/build_dbcsr/Makefile:179: libdbcsr] Error 2<br />make[2]: *** [/home/jibiaoli/codes/cp2k/exts/Makefile.inc:38: dbcsr] Error 2<br />make[2]: *** Waiting for unfinished jobs....<br />make[1]: *** [/home/jibiaoli/codes/cp2k/Makefile:128: psmp] Error 2<br />make: *** [Makefile:123: all] Error 2<br /><div><br /></div><div>Your help is highly required!</div><div><br /></div><div>Regards</div><div><br /></div><div>Jibiao Li</div><div>Chongqing, China</div>

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