[CPMD-list] cpmd2cube segmentation fault error

[haider abbas]

Dear all cpmd user,

running cpmd2cube shows the following error

[haider at falcon1 cpmd2cube]$ cpmd2cube.x  -rho
-halfmesh ELPOT
  
.read input file ... done
I think you stored a density (sum^2 =  0.77965627E-03)
.building g vectors ... done
forrtl: severe (174): SIGSEGV, segmentation fault
occurred
Image              PC        Routine            Line  
     Source
cpmd2cube.x        08055F58  Unknown              
Unknown  Unknown
cpmd2cube.x        0805404E  Unknown              
Unknown  Unknown
cpmd2cube.x        0805880F  Unknown              
Unknown  Unknown
cpmd2cube.x        0806C9D8  Unknown              
Unknown  Unknown
cpmd2cube.x        00763E33  Unknown              
Unknown  Unknown
cpmd2cube.x        08049CE1  Unknown              
Unknown  Unknown


the makefile of cpmd2cube.x is 

#-----------------------------------------------------------------------------#
# Makefile for cpmd2cube.x
# Configuration: Linux-PC-IFC-P4
# Creation of Makefile: Nov 23 2005
# on Linux robin 2.4.21-15.EL #1 Sun May 16 02:45:06
EDT 2004 i686 athlon i386 GNU/Linux
# Author: haider
#----------------------------------------------------------------------------
#
SHELL = /bin/sh
#
#--------------- Configuration
FC	= ifc
FFLAGS	=  -FR -D__IFC -DFFT_DEFAULT -O -tpp7 -w90 -w95
-pc64
LFLAGS	= -O -tpp7 -w90 -w95 -pc64
LIBS	=  -Vaxlib 
# uncomment and set only if needed
#CC	= cc
#CFLAGS	= 
#--------------- End of Configuration
##############

EXE	= cpmd2cube.x

OBJECTS	= \
    kinds.o periodic_table.o util.o grids.o
cpmd2cube.o \
    main.o grid_types.o atom_types.o readwrites.o     
 \
    fftsg_lib.o fft_tools.o fftsg.o

CFGDEST = .
CFGMACH = Linux-PC-IFC-P4
SRC=.

#############################

all:  $(EXE) trimcube

$(EXE): $(OBJECTS)
	 $(FC) -o $(EXE) $(LFLAGS) $(OBJECTS) $(LIBS)

trimcube: trimcube.o
	$(CC) $(CFLAGS) -o $@ trimcube.o 
#############################
clean:
	rm -f *.o *.mod *.L *~

# Create a new makefile with new dependencies but
retain the configuration.
reconfig:
	( cd $(SRC) ; ./Configure -r -m -SRC=$(SRC)
-DEST=$(CFGDEST) $(CFGMACH) ; cd $(CFGDEST) )

#############################
atom_types.o:  $(SRC)/atom_types.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

cpmd2cube.o:   $(SRC)/cpmd2cube.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

fft_tools.o:   $(SRC)/fft_tools.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

grid_types.o:  $(SRC)/grid_types.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

grids.o:       $(SRC)/grids.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

main.o:        $(SRC)/main.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

periodic_table.o: $(SRC)/periodic_table.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

readwrites.o:  $(SRC)/readwrites.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

util.o:       $(SRC)/util.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

kinds.o:      $(SRC)/kinds.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

fftsg.o:      $(SRC)/fftsg.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

fftsg_lib.o:  $(SRC)/fftsg_lib.F
	$(FC) -c $(FFLAGS) $(SRC)/$*.F

trimcube.o:	$(SRC)/trimcube.c
	$(CC) -c $(CFLAGS) $(SRC)/$*.c

# Dependencies
atom_types.o:  kinds.o \
		periodic_table.o

cpmd2cube.o:   atom_types.o \
		fft_tools.o \
		grid_types.o \
		grids.o \
		kinds.o \
		periodic_table.o \
		readwrites.o \
		util.o

fft_tools.o:   grid_types.o \
		fftsg_lib.o \
		kinds.o

grid_types.o:  kinds.o

grids.o:       grid_types.o \
		kinds.o \
		util.o

main.o:        cpmd2cube.o

periodic_table.o: kinds.o

readwrites.o:  atom_types.o \
		grid_types.o \
		kinds.o

util.o:       kinds.o

i have also tried it on a 1GB ram pc but its showing
the same error
could you please tell me what is wrong 
thanks
yours sincerely
Haider Abbas



		
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