Install lammps or abinit with clmath

[ndjoy...@gmail.com]

Hi everone!
I try appml / clMath (clFft) compiled Lammps, but after I added the
appropriate environment make linux given, it should be about changing the
FFTW result. I would like to ask you, whether by replacing the FFTW
library that implements the AMD GPU computing.
lammps version lammps-30Oct13
libclFFT.so.2.1.0==>libfftw.so
clAmdFft.h==>fftw.h
Makefile
CC =            mpicc
CCFLAGS =       -O
SHFLAGS =       -fPIC
DEPFLAGS =      -M

LINK =          mpicc
LINKFLAGS =     -O
LIB =           -lstdc++
SIZE =          size

ARCHIVE =       ar
ARFLAGS =       -rc
SHLIBFLAGS =    -shared
LMP_INC =       -DLAMMPS_GZIP -DLAMMPS_JPEG

MPI_INC =       -DMPICH_SKIP_MPICXX
MPI_PATH =
MPI_LIB =       -lmpich -lmpl -lpthread
FFT_INC =       -DFFT_FFTW
-I/home/zpg/Downloads/clFFT-develop/src/include/ -I/opt/AMDAPP/include/
FFT_PATH =
FFT_LIB =       /home/zpg/Downloads/clFFT-develop/src/library/libfftw.so

Error message：

mpicc -O  -DLAMMPS_GZIP -DLAMMPS_JPEG  -DMPICH_SKIP_MPICXX  -DFFT_FFTW 
-I/home/zpg/Downloads/clFFT-develop/src/include/ -I/opt/AMDAPP/include/  
-c ../ewald_disp.cpp
mpicc -O  -DLAMMPS_GZIP -DLAMMPS_JPEG  -DMPICH_SKIP_MPICXX  -DFFT_FFTW 
-I/home/zpg/Downloads/clFFT-develop/src/include/ -I/opt/AMDAPP/include/  
-c ../fft3d.cpp
In file included from ../fft3d.cpp:25:
../fft3d.h:214: 错误：‘FFTW_COMPLEX’没有命名一个类型
../fft3d.h:250: 错误：ISO C++ 不允许声明无类型的‘FFT_DATA’
../fft3d.h:250: 错误：expected ‘;’ before ‘*’ token
../fft3d.h:251: 错误：ISO C++ 不允许声明无类型的‘FFT_DATA’
../fft3d.h:251: 错误：expected ‘;’ before ‘*’ token
../fft3d.h:292: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:293: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:294: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:295: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:296: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:297: 错误：‘fftw_plan’没有命名一个类型
../fft3d.h:318: 错误：变量或字段‘fft_3d’声明为 void
../fft3d.h:318: 错误：‘FFT_DATA’在此作用域中尚未声明
../fft3d.h:318: 错误：expected primary-expression before ‘,’ token
../fft3d.h:318: 错误：‘FFT_DATA’在此作用域中尚未声明
../fft3d.h:318: 错误：expected primary-expression before ‘,’ token
../fft3d.h:318: 错误：expected primary-expression before ‘int’
../fft3d.h:318: 错误：expected primary-expression before ‘struct’
../fft3d.h:326: 错误：变量或字段‘fft_1d_only’声明为 void
../fft3d.h:326: 错误：‘FFT_DATA’在此作用域中尚未声明
../fft3d.h:326: 错误：expected primary-expression before ‘,’ token
../fft3d.h:326: 错误：expected primary-expression before ‘int’
../fft3d.h:326: 错误：expected primary-expression before ‘int’
../fft3d.h:326: 错误：expected primary-expression before ‘struct’
../fft3d.cpp:66: 错误：变量或字段‘fft_3d’声明为 void
../fft3d.cpp:66: 错误：‘FFT_DATA’在此作用域中尚未声明
../fft3d.cpp:66: 错误：‘in’在此作用域中尚未声明
../fft3d.cpp:66: 错误：‘FFT_DATA’在此作用域中尚未声明
../fft3d.cpp:66: 错误：‘out’在此作用域中尚未声明
../fft3d.cpp:66: 错误：expected primary-expression before ‘int’
../fft3d.cpp:66: 错误：expected primary-expression before ‘struct’ make[1]:
*** [fft3d.o] 错误 1
make[1]: Leaving directory
`/home/zpg/Downloads/lammps-30Oct13/src/Obj_linux' make: *** [linux] 错误 2

[Jeff Hammond]

This is a LAMMPS-related problem. Write the LAMMPS user list for assistance. I know what they'll tell you though...

Jeff

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