| 查看: 1076 | 回复: 2 | |||||
[求助]
boltztrap 1.2.2 编译总是出错，那位高手帮忙看看。
|
|
以下内容是makefile 程序shell 文件 SHELL = /bin/sh # gfortran #FC = gfortran #FOPT = -g -Wall -march=native -funroll-loops -O3 -ffast-math -fgcse-lm -fgcse-sm -ffast-math -ftree-vectorize -fexternal-blas -fbounds-check -finit-integer=-666 -finit-real=nan #LDFLAGS = #LIBS = -llapack -latlas -lblas # ifort FC = ifort #FOPT = -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML #LDFLAGS = -L/opt/intel/mkl/10.0.1.014/lib/32/ -Vaxlib -static-libcxa -pthread #LIBS = -lmkl_lapack -lmkl_ia32 -lguide # ifort bis: other mkl options #LDFLAGS = $(FOPT) -L/opt/intel/mkl/10.0.1.014/lib/32 -pthread -i-static #LIBS = -lmkl_lapack -lmkl -lguide LDFLAGS = -openmp -I$(MKLROOT)/include/intel64/lp64 -I/public/software/intel/composer_xe_2011_sp1.7.256/mkl/include R_LIBS = /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blas95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_lapack95_lp64.a -Wl,--start-group /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_thread.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.a -Wl,--end-group -lpthread -lm C_LIBS = $(R_LIBS) RP_LIBS = /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blas95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_lapack95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_cdft_core.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_sequential.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a -Wl,--end-group -lpthread -lm /public/software/mathlib/fftw215-wien2k/lib/libfftw_mpi.a /public/software/mathlib/fftw215-wien2k/lib/libfftw.a CP_LIBS = $(RP_LIBS) # generic LINKER = $(FC) LFLAGS = FGEN = DESTDIR = . EXECNAME = BoltzTraP ############################################################################### FFLAGS = $(FGEN) $(FOPT) EXEC = $(DESTDIR)/$(EXECNAME) #.............................................................................. # # Object files common to both REAL and COMPLEX type subroutines # OBJS = reallocate.o gmlib2.o latgen2.o m_bandstructure.o m_input.o generic_lifetime.o gtfnam.o gen_lattpoints.o \ BoltzTraP.o wien_band.o phon_band.o generic_band.o pw_interface.o \ add_inv.o bandana.o stern1.o kdelta.o fite4.o sortag.o gplbands.o \ dos.o ifflim.o setfft.o c3fft.o fermiintegrals.o bands.o kcomp.o \ bz.o fermisurface.o setfft2.o write_dx_fs.o write_dx_bz.o write_cube_fs.o \ dos_histogram.o dos_tetra.o noculc.o #OBJS = \ # reallocate.o defs.o modules.o broad.o add_inv.o \ # c3fft.o gtfnam.o ifflim.o mknam.o read_energy.o \ # transport.o stern.o kdelta.o gen_lattpoints.o fite4.o setfft.o \ # starfkt2.o dos.o $(EXEC): $(OBJS) $(LINKER) $(LFLAGS) -o $(EXEC) $(OBJS) $(LDFLAGS) $(LIBS) $(LFLAGS) clean: rm -f *.o *.mod *.pc *.pcl *~ .SUFFIXES: .F90 .o .F90.o: $(FC) $(FFLAGS) -c $< (END) # generic LINKER = $(FC) LFLAGS = FGEN = DESTDIR = . 以上是shell 程序 我执行make命令 ifort -o ./BoltzTraP reallocate.o gmlib2.o latgen2.o m_bandstructure.o m_input. o generic_lifetime.o gtfnam.o gen_lattpoints.o BoltzTraP.o wien_band.o phon_band .o generic_band.o pw_interface.o add_inv.o bandana.o stern1.o kdelta.o fite4.o s ortag.o gplbands.o dos.o ifflim.o setfft.o c3fft.o fermiintegrals.o bands.o kco mp.o bz.o fermisurface.o setfft2.o write_dx_fs.o write_dx_bz.o write_cube_fs.o d os_histogram.o dos_tetra.o noculc.o -openmp -I/public/software/intel/composer_xe _2011_sp1.7.256/mkl/include/intel64/lp64 -I/public/software/intel/composer_xe_20 11_sp1.7.256/mkl/include fite4.o: In function `fite4_': fite4.F90  .text+0x217b): undefined reference to `dgemm_'fite4.F90 .text+0x2293): undefined reference to `dgetrf_'fite4.F90 .text+0x239f): undefined reference to `dgetrs_'make: *** [BoltzTraP] 错误 1 一直在探索 却不知如何解决还望高手指导！ |
回复此楼» 收录本帖的淘帖专辑推荐
 热电材料（实验与计算） | 软件安装交流 |
» 猜你喜欢
复试调剂
已经有21人回复
-
求调剂学校
已经有13人回复
-
291 求调剂
已经有39人回复
-
271求调剂
已经有30人回复
-
材料类284调剂
已经有50人回复
-
291分调剂
已经有9人回复
-
调剂求收留
已经有34人回复
-
22408 312求调剂
已经有17人回复
-
一志愿华中农业071010，320求调剂
已经有6人回复
-
290调剂生物0860
已经有41人回复
» 本主题相关价值贴推荐，对您同样有帮助:
- BoltzTraP执行出错
已经有8人回复
花无刺
木虫 (著名写手)
二师兄
- 应助: 24 (小学生)
- 金币: 4315.3
- 散金: 6
- 红花: 109
- 帖子: 1060
- 在线: 604小时
- 虫号: 148310
- 注册: 2005-12-28
- 性别: GG
- 专业: 凝聚态物性 II ：电子结构
【答案】应助回帖
★ ★
感谢参与，应助指数 +1
fzx2008: 金币+2, 谢谢指教！ 2012-11-01 20:02:10
感谢参与，应助指数 +1
fzx2008: 金币+2, 谢谢指教！ 2012-11-01 20:02:10
|
FC = ifort #FOPT = -FR -mp1 -w -prec_div -pc80 -pad -ip -DINTEL_VML 这个#去掉 下面这个乱七八糟，删除： R_LIBS = /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blas95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_lapack95_lp64.a -Wl,--start-group /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_thread.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.a -Wl,--end-group -lpthread -lm C_LIBS = $(R_LIBS) RP_LIBS = /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blas95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_lapack95_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_scalapack_lp64.a -Wl,--start-group /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_cdft_core.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_intel_lp64.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_sequential.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_core.a /public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/intel64/libmkl_blacs_openmpi_lp64.a -Wl,--end-group -lpthread -lm /public/software/mathlib/fftw215-wien2k/lib/libfftw_mpi.a /public/software/mathlib/fftw215-wien2k/lib/libfftw.a 改为： LDFLAGS = $(FOPT) -L/public/software/intel/composer_xe_2011_sp1.7.256/mkl/lib/em64t -pthread -i-static LIBS = -lmkl_lapack95_lp64 -lmkl_intel_lp64 -lmkl_sequential -lmkl_core |
» 本帖已获得的红花（最新10朵）
kuiziyang2楼2012-11-01 19:27:51
3楼2012-11-02 08:51:00
