<div>Thank you. Dummy argument, the third error still be there.</div><br><br><br><div>From Meizu MX5</div><br id="mzDivider"><br><br>-------- Original message --------<br>Sender: Paolo Giannozzi <p.giannozzi@gmail.com><br>Time: Mon 11/2 15:14<br>To: PWSCF Forum <pw_forum@pwscf.org><br> Subject: Re: [Pw_forum] compilation aborted for realus.f90<br><br><div dir="ltr"><div>Compiler version? (very) old versions of the Intel and gfortran compilers may not be able to compile recent versions of QE.<br><br></div>Paolo<br></div><div class="gmail_extra"><br><div class="gmail_quote">On Mon, Nov 2, 2015 at 4:34 AM, ye ji <span dir="ltr"><<a href="mailto:silentmlight@gmail.com" target="_blank">silentmlight@gmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div><font face="楷体,楷体_GB2312">Hello,<br><br></font></div><font face="楷体,楷体_GB2312">I
am a newbie in DFT calculation and I am trying to compile Espresso
5.2.1 on our cluster. ./configure runs smoothly but some error occurs
when make. like this...<br><br> mpif90 -O2 -assume byterecl -g
-traceback -nomodule -fpp -D__INTEL -D__FFTW -D__MPI -D__PARA
-D__SCALAPACK -I../../iotk/src -I../../Modules -c
add_vhub_to_deeq.f90<br>mpif90 -O2 -assume byterecl -g -traceback
-nomodule -fpp -D__INTEL -D__FFTW -D__MPI -D__PARA -D__SCALAPACK
-I../../iotk/src -I../../Modules -c realus.f90<br>fortcom: Error: realus.f90, line 63: This entity cannot be PUBLIC since its derived type is PRIVATE. [TABP]<br> TYPE(realsp_augmentation),POINTER :: tabp(:) => null()<br>---------------------------------------^<br>fortcom: Error: realus.f90, line 65: This entity cannot be PUBLIC since its derived type is PRIVATE. [TABS]<br> TYPE(realsp_augmentation),POINTER :: tabs(:) => null()<br>---------------------------------------^<br>fortcom:
Error: realus.f90, line 204: This procedure cannot be PUBLIC since it
has argument(s) whose derived type(s) are PRIVATE. [TABP]<br> SUBROUTINE qpointlist(dfft, tabp)<br>--------------------------------^<br>fortcom:
Error: realus.f90, line 391: A pointer dummy argument with the
INTENT(IN) attribute shall not appear as an actual argument if the
associated dummy argument has the INTENT(OUT) or INTENT(INOUT)
attribute. [TABP]<br> CALL real_space_q( nt, ia, mbia, tabp )<br>------------------------------------------^<br>compilation aborted for realus.f90 (code 1)<br>make[2]: *** [realus.o] 错误 1 (错误 is error in Chinese)<br>make[2]: Leaving directory `/home/jiye/QE/PW/src' <br>make[1]: *** [pw] 错误 1<br>make[1]: Leaving directory `/home/jiye/QE/PW'<br>make: *** [pw] 错误 1<br><br>I'
ve also tried several other versions, only 4.1.3 could make
successfully with "--disable-shared", however, pw.x doesn't work for all
examples. The math library is intel MKL and I've tried both ifort and
gfortran as compiler and -O0 optimize level. </font><font face="楷体,楷体_GB2312"><font face="楷体,楷体_GB2312">(I've searched the archive to find solutions and tried to use internal libraries yet not helpful.)<br><br></font>Please see my make.sys file
for details. I would appreciate any help.</font><br clear="all"><br>Best,<br><br>Ye Ji
</div>
<br>_______________________________________________<br>
Pw_forum mailing list<br>
<a href="mailto:Pw_forum@pwscf.org">Pw_forum@pwscf.org</a><br>
<a href="http://pwscf.org/mailman/listinfo/pw_forum" rel="noreferrer" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br></blockquote></div><br><br clear="all"><br>-- <br><div class="gmail_signature"><div dir="ltr"><div><div dir="ltr"><span><span><font color="#888888">Paolo Giannozzi, Dept. Chemistry&Physics&Environment,<br>
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy<br>
Phone <a href="tel:%2B39-0432-558216" value="+390432558216" target="_blank">+39-0432-558216</a>, fax <a href="tel:%2B39-0432-558222" value="+390432558222" target="_blank">+39-0432-558222</a></font></span></span></div></div></div></div>
</div>