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小木虫论坛-学术科研互动平台 » 计算模拟区 » 第一性原理 » Vasp&MedeA » 【求助】VASP 编译出错
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wzh上善若水

木虫 (著名写手)

[交流] 【求助】VASP 编译出错 已有5人参与

所用软件如下：
l_cprof_p_11.1.064.tgz     atlas3.4.1_Linux_IA64Itan_2.tgz   vasp.4.6.tar.gz
vasp.4.lib.tar.gz
Vasp 编译出错，我吧错误和  makefile   复制如下，请大侠帮忙解决，非常感谢！
./preprocess base.f90  -DHOST=\"LinuxIFC_ath\" -Dkind8 -DNGXhalf -DCACHE_SIZE=5000 -DPGF90 -Davoidalloc -DRPROMU_DGEMV

ifort -FR -lowercase -assume byterecl  -O3 -axK -tpp6  -c base.f90

ifort: command line error: option '-axK' not supported
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1楼 2010-04-20 21:05:34
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wzh上善若水(金币+1): 2010-04-21 09:33
楼上正解，去掉-axk就行
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4楼2010-04-21 08:00:32
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wzh上善若水

木虫 (著名写手)

makefile 复制如下

.SUFFIXES: .inc .f .f90 .F
#-----------------------------------------------------------------------
# Makefile for Intel Fortran compiler for Athlon XP systems
#
# The makefile was tested only under Linux on Intel platforms
# (Suse 5.3- Suse 9.0)
# the followin compiler versions have been tested
# 5.0, 6.0, 7.0 and 7.1 (some 8.0 versions seem to fail compiling the code)
# presently we recommend version 7.1 or 7.0, since these
# releases have been used to compile the present code versions
#
# it might be required to change some of library pathes, since
# LINUX installation vary a lot
# Hence check ***ALL**** options in this makefile very carefully
#-----------------------------------------------------------------------
#
# BLAS must be installed on the machine
# there are several options:
# 1) very slow but works:
#   retrieve the lapackage from ftp.netlib.org
#   and compile the blas routines (BLAS/SRC directory)
#   please use g77 or f77 for the compilation. When I tried to
#   use pgf77 or pgf90 for BLAS, VASP hang up when calling
#   ZHEEV  (however this was with lapack 1.1 now I use lapack 2.0)
# 2) most desirable: get an optimized BLAS
#
# the two most reliable packages around are presently:
# 3a) Intels own optimised BLAS (PIII, P4, Itanium)
#     http://developer.intel.com/software/products/mkl/
#   this is really excellent when you use Intel CPU's
#
# 3b) or obtain the atlas based BLAS routines
#     http://math-atlas.sourceforge.net/
#   you certainly need atlas on the Athlon, since the  mkl
#   routines are not optimal on the Athlon.
#   If you want to use atlas based BLAS, check the lines around LIB=
#
# 3c) mindblowing fast SSE2 (4 GFlops on P4, 2.53 GHz)
#   Kazushige Goto's BLAS
#   http://www.cs.utexas.edu/users/kgoto/signup_first.html
#
#-----------------------------------------------------------------------

# all CPP processed fortran files have the extension .f90
SUFFIX=.f90

#-----------------------------------------------------------------------
# fortran compiler and linker
#-----------------------------------------------------------------------
FC=ifort
# fortran linker
FCL=$(FC)


#-----------------------------------------------------------------------
# whereis CPP ?? (I need CPP, can't use gcc with proper options)
# that's the location of gcc for SUSE 5.3
#
#  CPP_   =  /usr/lib/gcc-lib/i486-linux/2.7.2/cpp -P -C
#
# that's probably the right line for some Red Hat distribution:
#
#  CPP_   =  /usr/lib/gcc-lib/i386-redhat-linux/2.7.2.3/cpp -P -C
#
#  SUSE X.X, maybe some Red Hat distributions:

CPP_ =  ./preprocess <$*.F | /usr/bin/cpp -P -C -traditional >$*$(SUFFIX)

#-----------------------------------------------------------------------
# possible options for CPP:
# NGXhalf             charge density   reduced in X direction
# wNGXhalf            gamma point only reduced in X direction
# avoidalloc          avoid ALLOCATE if possible
# IFC                 work around some IFC bugs
# CACHE_SIZE          1000 for PII,PIII, 5000 for Athlon, 8000-12000 P4
# RPROMU_DGEMV        use DGEMV instead of DGEMM in RPRO (depends on used BLAS)
# RACCMU_DGEMV        use DGEMV instead of DGEMM in RACC (depends on used BLAS)
# for Atlas  -DRPROMU_DGEMV is recommended
#-----------------------------------------------------------------------

CPP     = $(CPP_)  -DHOST=\"LinuxIFC_ath\" \
          -Dkind8 -DNGXhalf -DCACHE_SIZE=5000 -DPGF90 -Davoidalloc \
          -DRPROMU_DGEMV

#-----------------------------------------------------------------------
# general fortran flags  (there must a trailing blank on this line)
#-----------------------------------------------------------------------

FFLAGS =  -FR -lowercase -assume byterecl

#-----------------------------------------------------------------------
# optimization
# we have tested whether higher optimisation improves performance
# -axK  SSE1 optimization,  but also generate code executable on all mach.
#       xK improves performance somewhat on XP, and a is required in order
#       to run the code on older Athlons as well
# -xW   SSE2 optimization
# -axW  SSE2 optimization,  but also generate code executable on all mach.
# -tpp6 P3 optimization
# -tpp7 P4 optimization
#-----------------------------------------------------------------------

OFLAG=-O3 -axK -tpp6

OFLAG_HIGH = $(OFLAG)
OBJ_HIGH =

OBJ_NOOPT =
DEBUG  = -FR -O0
INLINE = $(OFLAG)


#-----------------------------------------------------------------------
# the following lines specify the position of BLAS  and LAPACK
# on Athlon, VASP works fastest with the Atlas library
# so that's what I recommend
#-----------------------------------------------------------------------

# Atlas based libraries
ATLASHOME= /opt/Linux_IA64Itan_2/lib
BLAS=   -L$(ATLASHOME)  -lf77blas -latlas

# use the mkl Intel libraries for p4 (www.intel.com)
# mkl.5.1
# set -DRPROMU_DGEMV  -DRACCMU_DGEMV in the CPP lines
#BLAS=-L/opt/intel/mkl/lib/32 -lmkl_p4  -lpthread

# mkl.5.2 requires also to -lguide library
# set -DRPROMU_DGEMV  -DRACCMU_DGEMV in the CPP lines
#BLAS=-L/opt/intel/mkl/lib/32 -lmkl_p4 -lguide -lpthread

# even faster Kazushige Goto's BLAS
# http://www.cs.utexas.edu/users/kgoto/signup_first.html
#BLAS=  /opt/libs/libgoto/libgoto_p4_512-r0.6.so

# LAPACK, simplest use vasp.4.lib/lapack_double
#LAPACK= ../vasp.4.lib/lapack_double.o

# use atlas optimized part of lapack
LAPACK= ../vasp.4.lib/lapack_atlas.o -llapack -lcblas

# use the mkl Intel lapack
#LAPACK= -lmkl_lapack

#-----------------------------------------------------------------------

LIB  = -L../vasp.4.lib -ldmy \
     ../vasp.4.lib/linpack_double.o $(LAPACK) \
     $(BLAS)

# options for linking (for compiler version 6.X, 7.1) nothing is required
LINK    =
# compiler version 7.0 generates some vector statments which are located
# in the svml library, add the LIBPATH and the library (just in case)
#LINK    =  -L/opt/intel/compiler70/ia32/lib/ -lsvml

#-----------------------------------------------------------------------
# fft libraries:
# VASP.4.6 can use fftw.3.0.X (http://www.fftw.org)
# since this version is faster on P4 machines, we recommend to use it
#-----------------------------------------------------------------------

FFT3D   = fft3dfurth.o fft3dlib.o
#FFT3D   = fftw3d.o fft3dlib.o   /opt/libs/fftw-3.0.1/lib/libfftw3.a


#=======================================================================
# MPI section, uncomment the following lines
#
# one comment for users of mpich or lam:
# You must *not* compile mpi with g77/f77, because f77/g77            
# appends *two* underscores to symbols that contain already an        
# underscore (i.e. MPI_SEND becomes mpi_send__).  The pgf90/ifc
# compilers however append only one underscore.
# Precompiled mpi version will also not work !!!
#
# We found that mpich.1.2.1 and lam-6.5.X to lam-7.0.4 are stable
# mpich.1.2.1 was configured with
#  ./configure -prefix=/usr/local/mpich_nodvdbg -fc="pgf77 -Mx,119,0x200000"  \
# -f90="pgf90 -Mx,119,0x200000" \
# --without-romio --without-mpe -opt=-O \
#
# lam was configured with the line
#  ./configure  -prefix /opt/libs/lam-7.0.4 --with-cflags=-O -with-fc=ifc \
# --with-f77flags=-O --without-romio
#
# please note that you might be able to use a lam or mpich version
# compiled with f77/g77, but then you need to add the following
# options: -Msecond_underscore (compilation) and -g77libs (linking)
#
# !!! Please do not send me any queries on how to install MPI, I will
# certainly not answer them !!!!
#=======================================================================
#-----------------------------------------------------------------------
# fortran linker for mpi: if you use LAM and compiled it with the options
# suggested above,  you can use the following line
#-----------------------------------------------------------------------

#FC=mpif77
#FCL=$(FC)

#-----------------------------------------------------------------------
# additional options for CPP in parallel version (see also above):
# NGZhalf               charge density   reduced in Z direction
# wNGZhalf              gamma point only reduced in Z direction
# scaLAPACK             use scaLAPACK (usually slower on 100 Mbit Net)
# 1000 or 2000 are the optimal CACHE_SIZE for the parallel version
# and IFC on Athlon XP (gK)
#-----------------------------------------------------------------------

#CPP    = $(CPP_) -DMPI  -DHOST=\"LinuxIFC_ath\" -DIFC \
#     -Dkind8 -DNGZhalf -DCACHE_SIZE=2000 -DPGF90 -Davoidalloc \
#     -DRPROMU_DGEMV

#-----------------------------------------------------------------------
# location of SCALAPACK
# if you do not use SCALAPACK simply uncomment the line SCA
#-----------------------------------------------------------------------

BLACS=$(HOME)/archives/SCALAPACK/BLACS/
SCA_=$(HOME)/archives/SCALAPACK/SCALAPACK

SCA= $(SCA_)/libscalapack.a  \
$(BLACS)/LIB/blacsF77init_MPI-LINUX-0.a $(BLACS)/LIB/blacs_MPI-LINUX-0.a $(BLACS)/LIB/blacsF77init_MPI-LINUX-0.a

SCA=

#-----------------------------------------------------------------------
# libraries for mpi
#-----------------------------------------------------------------------

#LIB     = -L../vasp.4.lib -ldmy  \
#      ../vasp.4.lib/linpack_double.o $(LAPACK) \
#      $(SCA) $(BLAS)

# FFT: fftmpi.o with fft3dlib of Juergen Furthmueller
#FFT3D   = fftmpi.o fftmpi_map.o fft3dlib.o

# fftw.3.0.1 is slighly faster and should be used if available
#FFT3D   = fftmpiw.o fftmpi_map.o fft3dlib.o   /opt/libs/fftw-3.0.1/lib/libfftw3.a

#-----------------------------------------------------------------------
# general rules and compile lines
#-----------------------------------------------------------------------
BASIC=   symmetry.o symlib.o   lattlib.o  random.o   

SOURCE=  base.o     mpi.o      smart_allocate.o      xml.o  \
         constant.o jacobi.o   main_mpi.o  scala.o   \
         asa.o      lattice.o  poscar.o   ini.o      setex.o     radial.o  \
         pseudo.o   mgrid.o    mkpoints.o wave.o      wave_mpi.o  $(BASIC) \
         nonl.o     nonlr.o    dfast.o    choleski2.o    \
         mix.o      charge.o   xcgrad.o   xcspin.o    potex1.o   potex2.o  \
         metagga.o  constrmag.o pot.o      cl_shift.o force.o    dos.o      elf.o      \
         tet.o      hamil.o    steep.o    \
         chain.o    dyna.o     relativistic.o LDApU.o sphpro.o  paw.o   us.o \
         ebs.o      wavpre.o   wavpre_noio.o broyden.o \
         dynbr.o    rmm-diis.o reader.o   writer.o   tutor.o xml_writer.o \
         brent.o    stufak.o   fileio.o   opergrid.o stepver.o  \
         dipol.o    xclib.o    chgloc.o   subrot.o   optreal.o   davidson.o \
         edtest.o   electron.o shm.o      pardens.o  paircorrection.o \
         optics.o   constr_cell_relax.o   stm.o    finite_diff.o \
         elpol.o    setlocalpp.o

INC=

vasp: $(SOURCE) $(FFT3D) $(INC) main.o
        rm -f vasp
        $(FCL) -o vasp $(LINK) main.o  $(SOURCE)   $(FFT3D) $(LIB)
makeparam: $(SOURCE) $(FFT3D) makeparam.o main.F $(INC)
        $(FCL) -o makeparam  $(LINK) makeparam.o $(SOURCE) $(FFT3D) $(LIB)
zgemmtest: zgemmtest.o base.o random.o $(INC)
        $(FCL) -o zgemmtest $(LINK) zgemmtest.o random.o base.o $(LIB)
dgemmtest: dgemmtest.o base.o random.o $(INC)
        $(FCL) -o dgemmtest $(LINK) dgemmtest.o random.o base.o $(LIB)
ffttest: base.o smart_allocate.o mpi.o mgrid.o random.o ffttest.o $(FFT3D) $(INC)
        $(FCL) -o ffttest $(LINK) ffttest.o mpi.o mgrid.o random.o smart_allocate.o base.o $(FFT3D) $(LIB)
kpoints: $(SOURCE) $(FFT3D) makekpoints.o main.F $(INC)
        $(FCL) -o kpoints $(LINK) makekpoints.o $(SOURCE) $(FFT3D) $(LIB)

clean:       
        -rm -f *.g *.f *.o *.L *.mod ; touch *.F

main.o: main$(SUFFIX)
        $(FC) $(FFLAGS)$(DEBUG)  $(INCS) -c main$(SUFFIX)
xcgrad.o: xcgrad$(SUFFIX)
        $(FC) $(FFLAGS) $(INLINE)  $(INCS) -c xcgrad$(SUFFIX)
xcspin.o: xcspin$(SUFFIX)
        $(FC) $(FFLAGS) $(INLINE)  $(INCS) -c xcspin$(SUFFIX)

makeparam.o: makeparam$(SUFFIX)
        $(FC) $(FFLAGS)$(DEBUG)  $(INCS) -c makeparam$(SUFFIX)

makeparam$(SUFFIX): makeparam.F main.F
#
# MIND: I do not have a full dependency list for the include
# and MODULES: here are only the minimal basic dependencies
# if one strucuture is changed then touch_dep must be called
# with the corresponding name of the structure
#
base.o: base.inc base.F
mgrid.o: mgrid.inc mgrid.F
constant.o: constant.inc constant.F
lattice.o: lattice.inc lattice.F
setex.o: setexm.inc setex.F
pseudo.o: pseudo.inc pseudo.F
poscar.o: poscar.inc poscar.F
mkpoints.o: mkpoints.inc mkpoints.F
wave.o: wave.inc wave.F
nonl.o: nonl.inc nonl.F
nonlr.o: nonlr.inc nonlr.F

$(OBJ_HIGH):
        $(CPP)
        $(FC) $(FFLAGS) $(OFLAG_HIGH) $(INCS) -c $*$(SUFFIX)
$(OBJ_NOOPT):
        $(CPP)
        $(FC) $(FFLAGS) $(INCS) -c $*$(SUFFIX)

fft3dlib_f77.o: fft3dlib_f77.F
        $(CPP)
        $(F77) $(FFLAGS_F77) -c $*$(SUFFIX)

.F.o:
        $(CPP)
        $(FC) $(FFLAGS) $(OFLAG) $(INCS) -c $*$(SUFFIX)
.F$(SUFFIX):
        $(CPP)
$(SUFFIX).o:
        $(FC) $(FFLAGS) $(OFLAG) $(INCS) -c $*$(SUFFIX)

# special rules
#-----------------------------------------------------------------------
# -tpp5|6|7 P, PII-PIII, PIV
# -xW use SIMD (does not pay of on PII, since fft3d uses double prec)
# all other options do no affect the code performance since -O1 is used
#-----------------------------------------------------------------------

fft3dlib.o : fft3dlib.F
        $(CPP)
        $(FC) -FR -lowercase -e95 -vec_report3 -O1 -tpp6 -prefetch -unroll0 -c $*$(SUFFIX)
        $(CPP)
        $(FC) -FR -lowercase -e95 -c $*$(SUFFIX)

lattlib.o: lattlib.F
        $(CPP)
        $(FC) -FR -lowercase -e95 -c $*$(SUFFIX)

radial.o : radial.F
        $(CPP)
        $(FC) -FR -lowercase -O1 -c $*$(SUFFIX)

symlib.o : symlib.F
        $(CPP)
        $(FC) -FR -lowercase -O1 -c $*$(SUFFIX)

symmetry.o : symmetry.F
        $(CPP)
        $(FC) -FR -lowercase -O1 -c $*$(SUFFIX)

dynbr.o : dynbr.F
        $(CPP)
        $(FC) -FR -lowercase -O1 -c $*$(SUFFIX)

us.o : us.F
        $(CPP)
        $(FC) -FR -lowercase -O1 -c $*$(SUFFIX)

broyden.o : broyden.F
        $(CPP)
        $(FC) -FR -lowercase -O2 -c $*$(SUFFIX)

wave.o : wave.F
        $(CPP)
        $(FC) -FR -lowercase -O0 -c $*$(SUFFIX)

LDApU.o : LDApU.F
        $(CPP)
        $(FC) -FR -lowercase -O2 -c $*$(SUFFIX)
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知 止 而 后 有 定 ； 定 而 后 能 靜 ； 靜 而 后 能 安 ； 安 而 后 能 慮 ； 慮 而 后 能 得
2楼2010-04-20 21:06:07
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后天一

木虫 (小有名气)

我们的自由！
★
xiaohunhun(金币+1):xiexie 2010-04-20 23:57
wzh上善若水(金币+1): 2010-04-21 09:33
OFLAG=-O3 -axK -tpp6中的-axK不支持，删掉
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3楼2010-04-20 22:21:41
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wzh上善若水

木虫 (著名写手)

又出现这样的错误

引用回帖:
Originally posted by zzy870720z at 2010-04-21 08:00:32:
楼上正解，去掉-axk就行

(gedit:3014): EggSMClient-WARNING **: Failed to connect to the session manager: None of the authentication protocols specified are supported


(gedit:3014): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.YHAIBV': Permission denied

(gedit:3014): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.LHX4AV': Permission denied

(gedit:3014): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.ZQ60AV': Permission denied
wzh@wzh-desktop:/tmp/vasp.4.6$ make -f makefile.linux_ifc_ath
./preprocess lattlib.f90  -DHOST=\"LinuxIFC_ath\" -Dkind8 -DNGXhalf -DCACHE_SIZE=5000 -DPGF90 -Davoidalloc -DRPROMU_DGEMV
ifort  -FR -lowercase -e95 -c lattlib.f90
lattlib.f90(192): error #7342: The computed GOTO statement is an obsolescent feature in Fortran 95.
      GOTO (2,4,6,8,10,12,14,16,18,20,22,24,26,28,30) IBRAV
------^
lattlib.f90(707): error #5113: Extension to FORTRAN-90: tab formatting
               CELLDM(5)=(A3XA2*ABS2*ABS3+A3XA1*ABS1*ABS3)/ABS2P1/ABS3       
---------------------------------------------------------------------^
lattlib.f90(1368): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [300]
  300 CONTINUE
--^
lattlib.f90(1786): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    1 WRK(IA,I)=TAU(INDEX(IA),I)
----^
lattlib.f90(1786): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [1]
    1 WRK(IA,I)=TAU(INDEX(IA),I)
----^
lattlib.f90(1789): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    2 TAU(IA,I)=WRK(IA,I)
----^
lattlib.f90(1789): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [2]
    2 TAU(IA,I)=WRK(IA,I)
----^
lattlib.f90(1818): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    4    INDEX(NBEG+I)=INDEX(NBEG+I)+NBEG-1
----^
lattlib.f90(1828): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    7       TAU(INDEX(ICURR),K)=TEMP
----^
lattlib.f90(1861): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    9          INDEX(IBEG+I)=INDEX(IBEG+I)+IBEG-1
----^
lattlib.f90(1877): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
   13       TAU(INDEX(ICURR),K)=TEMP
---^
lattlib.f90(1895): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
   15 INDEX(IA)=NINT(WRK(IA,3))
---^
lattlib.f90(2420): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [13]
   13 CONTINUE
---^
compilation aborted for lattlib.f90 (code 1)
make: *** [lattlib.o] Error 1
wzh@wzh-desktop:/tmp/vasp.4.6$ gedit makefile.linux_ifc_ath

(gedit:3544): EggSMClient-WARNING **: Failed to connect to the session manager: None of the authentication protocols specified are supported


(gedit:3544): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.J174AV': Permission denied

(gedit:3544): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.2WP9AV': Permission denied

(gedit:3544): Gtk-WARNING **: Attempting to store changes into `/home/wzh/.recently-used.xbel', but failed: Failed to create file '/home/wzh/.recently-used.xbel.06OFBV': Permission denied
wzh@wzh-desktop:/tmp/vasp.4.6$ make -f makefile.linux_ifc_ath
./preprocess lattlib.f90  -DHOST=\"LinuxIFC_ath\" -Dkind8 -DNGXhalf -DCACHE_SIZE=5000 -DPGF90 -Davoidalloc -DRPROMU_DGEMV
ifort  -FR -lowercase -e95 -c lattlib.f90
lattlib.f90(192): error #7342: The computed GOTO statement is an obsolescent feature in Fortran 95.
      GOTO (2,4,6,8,10,12,14,16,18,20,22,24,26,28,30) IBRAV
------^
lattlib.f90(707): error #5113: Extension to FORTRAN-90: tab formatting
               CELLDM(5)=(A3XA2*ABS2*ABS3+A3XA1*ABS1*ABS3)/ABS2P1/ABS3       
---------------------------------------------------------------------^
lattlib.f90(1368): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [300]
  300 CONTINUE
--^
lattlib.f90(1786): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    1 WRK(IA,I)=TAU(INDEX(IA),I)
----^
lattlib.f90(1786): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [1]
    1 WRK(IA,I)=TAU(INDEX(IA),I)
----^
lattlib.f90(1789): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    2 TAU(IA,I)=WRK(IA,I)
----^
lattlib.f90(1789): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [2]
    2 TAU(IA,I)=WRK(IA,I)
----^
lattlib.f90(1818): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    4    INDEX(NBEG+I)=INDEX(NBEG+I)+NBEG-1
----^
lattlib.f90(1828): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    7       TAU(INDEX(ICURR),K)=TEMP
----^
lattlib.f90(1861): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
    9          INDEX(IBEG+I)=INDEX(IBEG+I)+IBEG-1
----^
lattlib.f90(1877): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
   13       TAU(INDEX(ICURR),K)=TEMP
---^
lattlib.f90(1895): error #6028: DO termination on a statement other than an END DO or CONTINUE is an obsolescent feature in Fortran 95.
   15 INDEX(IA)=NINT(WRK(IA,3))
---^
lattlib.f90(2420): error #6033: Sharing of a DO termination statement by more than one DO statement is an obsolescent feature in Fortran 95.  Use an END DO or CONTINUE statement for each DO statement.   [13]
   13 CONTINUE
---^
compilation aborted for lattlib.f90 (code 1)
make: *** [lattlib.o] Error 1
wzh@wzh-desktop:/tmp/vasp.4.6$
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