blob: 230f30f1bf323bc7dcac75ccf69cfa6ee6d1bbda (
plain)
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
|
CC = gcc
CXX = g++
CPP =
FC = mpifort
LD = mpifort
#
AR = ar -r
#
DFLAGS = -D__FFTW3 \
-D__LIBINT \
-D__parallel -D__SCALAPACK \
-D__ELPA \
-D__LIBXSMM \
-D__LIBXC \
-D__SPGLIB \
-D__PLUMED2
#
INCS = -I/usr/include \
-I/usr/include/elpa_openmp-$(_elpaver)/elpa \
-I/usr/include/elpa_openmp-$(_elpaver)/modules
#
OPTFLAGS = -O3 -march=native -fopenmp -ftree-vectorize
#
CFLAGS = $(DFLAGS) $(INCS) $(OPTFLAGS)
CXXFLAGS = $(DFLAGS) $(INCS) $(OPTFLAGS) -std=c++11
CPPFLAGS =
FCFLAGS = $(DFLAGS) $(INCS) $(OPTFLAGS) \
-ffree-form -ffree-line-length-none
#
LDFLAGS = $(FCFLAGS)
#
LIBS = -lxsmmf -lxsmm \
-lelpa_openmp -lscalapack -lblas -llapack \
-lfftw3 -lfftw3_threads \
/usr/lib/libint2.a \
-lxcf03 -lxc \
-lsymspg \
-l$(_plumed) \
-lstdc++ -lpthread -lm -ldl -lz
#
include /usr/lib/$(_plumed)/src/lib/Plumed.inc
|