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make.inc
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####################################################################
# make include file. #
####################################################################
#
SHELL = /bin/sh
# ----------------------------------------------------------------------
# - gpaw-cuda Directory Structure / gpaw-cuda library --------------------
# ----------------------------------------------------------------------
#
TOPdir = .
INCdir = $(TOPdir)
PYTHONINCdir ?= $(PYTHONHOME)/include/python2.7/
PYTHONLIBdir ?= $(PYTHONHOME)/lib/
NUMPYINCdir ?= `python -c "import numpy; print numpy.get_include()"`
MPIINCdir ?= /appl/opt/cluster_studio_xe2013/impi/4.1.3.045/intel64/include/
LIBdir = $(TOPdir)
CUGPAWLIB = $(LIBdir)/libgpaw-cuda.a
#
# Libxc
#
LIBXC_INC = $(LIBXCDIR)/include
#
# MKL
#
MKL_INC = $(MKLROOT)/include
#
# ----------------------------------------------------------------------
# - NVIDIA CUDA includes / libraries / specifics -----------------------
# ----------------------------------------------------------------------
CUDAINCdir = $(CUDADIR)/include
CUDALIBdir = $(CUDADIR)/lib64
CUDA_OPTS =
#
# ----------------------------------------------------------------------
# - gpaw-cuda includes / libraries / specifics -------------------------------
# ----------------------------------------------------------------------
#
CUGPAW_INCLUDES = -I$(INCdir) -I$(CUDAINCdir) -I$(MPIINCdir) -I$(NUMPYINCdir) -I$(PYTHONINCdir) -I$(LIBXC_INC) -I$(MKL_INC)
CUGPAW_OPTS = -DPARALLEL=1 -DGPAW_CUDA=1 -lxc
#
# ----------------------------------------------------------------------
#
CUGPAW_DEFS = $(CUGPAW_OPTS) $(CUDA_OPTS) $(CUGPAW_INCLUDES)
#
# ----------------------------------------------------------------------
# - Compilers / linkers - Optimization flags ---------------------------
# ----------------------------------------------------------------------
CC = icc
CCNOOPT = $(CUGPAW_DEFS)
CCFLAGS = $(CUGPAW_DEFS) -fPIC -std=c99 -m64 -O3
NVCC = nvcc -ccbin=icpc
NVCCFLAGS = $(CUGPAW_DEFS) -O3 -arch=sm_20 -m64 --compiler-options '-fPIC -O3'
ARCH = ar
ARCHFLAGS= cr
RANLIB = ranlib