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zb3ynf銀蟲(chóng) (初入文壇)
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[求助]
vasp環(huán)境變量libmkl_intel_lp64.so找不到問(wèn)題 已有2人參與
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請(qǐng)教大家,我之前成功安裝好的vasp軟件可以正常運(yùn)行,但是在我安裝了另一個(gè)計(jì)算軟件后,就不能運(yùn)行了,一直提示vasp: error while loading shared libraries: libmkl_intel_lp64.so: cannot open shared object file: No such file or directory,然而ldd vasp可以找到相關(guān)的鏈接,如下 linux-vdso.so.1 => (0x00007fffa83ff000) libmkl_intel_lp64.so => /opt/intel/cmkl/10.2.7.041/lib/em64t/libmkl_intel_lp64.so (0x00002b1beda0f000) libmkl_sequential.so => /opt/intel/cmkl/10.2.7.041/lib/em64t/libmkl_sequential.so (0x00002b1bedf10000) libmkl_core.so => /opt/intel/cmkl/10.2.7.041/lib/em64t/libmkl_core.so (0x00002b1bee846000) libpthread.so.0 => /lib64/libpthread.so.0 (0x0000003178e00000) libguide.so => /opt/intel/cmkl/10.2.7.041/lib/em64t/libguide.so (0x00002b1beed26000) libmpi_f90.so.1 => /opt/openmpi/lib/libmpi_f90.so.1 (0x00002b1beeef7000) libmpi_f77.so.1 => /opt/openmpi/lib/libmpi_f77.so.1 (0x00002b1bef0fa000) libmpi.so.1 => /opt/openmpi/lib/libmpi.so.1 (0x00002b1bef32e000) libdl.so.2 => /lib64/libdl.so.2 (0x0000003178200000) libm.so.6 => /lib64/libm.so.6 (0x0000003178a00000) librt.so.1 => /lib64/librt.so.1 (0x0000003179600000) libnsl.so.1 => /lib64/libnsl.so.1 (0x000000318ac00000) libutil.so.1 => /lib64/libutil.so.1 (0x0000003188200000) libc.so.6 => /lib64/libc.so.6 (0x0000003178600000) libgcc_s.so.1 => /lib64/libgcc_s.so.1 (0x000000317ea00000) /lib64/ld-linux-x86-64.so.2 (0x0000003177e00000) libifport.so.5 => /opt/intel/Compiler/11.1/080/lib/intel64/libifport.so.5 (0x00002b1bef6d0000) libifcore.so.5 => /opt/intel/Compiler/11.1/080/lib/intel64/libifcore.so.5 (0x00002b1bef80a000) libimf.so => /opt/intel/Compiler/11.1/080/lib/intel64/libimf.so (0x00002b1befa81000) libsvml.so => /opt/intel/Compiler/11.1/080/lib/intel64/libsvml.so (0x00002b1befe15000) libintlc.so.5 => /opt/intel/Compiler/11.1/080/lib/intel64/libintlc.so.5 (0x00002b1bf002c000) libifcoremt.so.5 => /opt/intel/Compiler/11.1/080/lib/intel64/libifcoremt.so.5 (0x00002b1bf016a000) 環(huán)境變量設(shè)置應(yīng)該沒(méi)問(wèn)題,但是運(yùn)行vasp就是提示找不到,但是vasp在root下可以運(yùn)行,請(qǐng)問(wèn)各位這是什么問(wèn)題? |
專(zhuān)家顧問(wèn) (著名寫(xiě)手)
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專(zhuān)家經(jīng)驗(yàn): +20 |
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??N????????? computing node ?h??????c server node ????? ?????????? server node ????? library ??^??? echo $LD_LIBRARY_PATH ??????G vasp job ?r???? job script ?????????@?? ?????GJOB??~ computing node ?????? library ????c server node ??? ??????????????_?? VASP ?????????? ?????@????????? job script ?????????? library path |
專(zhuān)家顧問(wèn) (著名寫(xiě)手)
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專(zhuān)家經(jīng)驗(yàn): +174 |

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