标题: cp2k 2026.1 安装时make出错,求大神帮助 [打印本页] 作者Author: fanchenm 时间: yesterday 14:42 标题: cp2k 2026.1 安装时make出错,求大神帮助 [ 62%] Building Fortran object src/CMakeFiles/cp2k.dir/kpoint_transitional.F.o
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/home/fanchen/cp2k-2026.1/build/src/tblite_types.F:17:7:
17 | USE mctc_io, ONLY: structure_type, new
| 1
Error: The rank of the element in the structure constructor at (1) does not match that of the component (0/1)
/home/fanchen/cp2k-2026.1/build/src/tblite_types.F:18:7:
18 | USE tblite_xtb_calculator, ONLY: xtb_calculator
| 1
Error: Invalid initialization expression for ALLOCATABLE component ‘repulsion’ in structure constructor at (1)
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make[2]: *** [src/CMakeFiles/cp2k.dir/build.make:15463: src/CMakeFiles/cp2k.dir/tblite_types.F.o] Error 1
make[2]: *** Waiting for unfinished jobs....
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make[1]: *** [CMakeFiles/Makefile2:236: src/CMakeFiles/cp2k.dir/all] Error 2
make: *** [Makefile:136: all] Error 2