求助：VASP编译最后报错build目录中的std目录下没有VASP文件

phyberg

vasp编译最后报错显示，std 目录下没有vasp文件，如下，与上面的undefined有关吗，要怎么解决，希望大家帮忙看看，谢谢。（用的Intel oneapi base toolkit 和 HPCkit；makefile.include 中加入了CPP_OPTIONS=-DVASP2WANNIER90v2 ，OFLAG     后面加上了-xhost，LLIBS      = /opt/wannier90-2.0.1/libwannier.a
）bse.o: In function `bse_mp_twoelectron4o_diag_scala_':
bse.f90:(.text+0x20e87): undefined reference to `blacs_gridinfo_'
bse.f90:(.text+0x20ea5): undefined reference to `numroc_'
bse.f90:(.text+0x20ec7): undefined reference to `numroc_'
bse.o: In function `bse_mp_tda_bse_eigenvectors_full_sca_':
bse.f90:(.text+0x26d03): undefined reference to `blacs_gridinfo_'
bse.f90:(.text+0x26d26): undefined reference to `numroc_'
bse.f90:(.text+0x26d4f): undefined reference to `numroc_'
bse.f90:(.text+0x27059): undefined reference to `pzgemm_'
bse.f90:(.text+0x28552): undefined reference to `pzgemm_'
bse.f90:(.text+0x285ec): undefined reference to `pzgemm_'

make[2]: *** [vasp] Error 1
make[2]: Leaving directory `/opt/vasp.5.4.4/build/std'
cp: cannot stat ‘vasp’: No such file or directory
make[1]: *** [all] Error 1
make[1]: Leaving directory `/opt/vasp.5.4.4/build/std'
make: *** [std] Error 2

wolfli369

建议选用intel2018或者之前的编译器试一下。自己编译发现2019，2020，oneapi都发现存在严重的内存泄露。