[Q-e-developers] Something wrong due to the esm module

Filippo SPIGA filippo.spiga at quantum-espresso.org
Mon Oct 26 21:15:06 CET 2015


Hello Xiaochuan,

Davide is right, it is a compiler problem, the FORTRAN seems correct to correct. Every other compiler work except two specific minor versions of Intel 13 (20130607, 20130514). For example another minor version of Intel 13.1 (icc (13.1.0 20130121) works.

HTH

--
Mr. Filippo SPIGA, M.Sc.
Quantum ESPRESSO Foundation
http://fspiga.github.io ~ skype: filippo.spiga

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> On Oct 26, 2015, at 8:11 PM, Davide Ceresoli <davide.ceresoli at istm.cnr.it> wrote:
> 
> Dear Xiaochuan,
>     I think it's compiler dependent. I've got the same error
> as you with Intel XE2013, no problems with Intel XE2015 and
> gfortran 4.8.
> 
> Best,
>     Davide
> 
> 
> On 10/26/2015 09:07 PM, xiaochuan Ge wrote:
>> Dear developers,
>> 
>> I noticed that since the version 11662, interface is used for several
>> subroutines in the PW/src/esm.f90 file. When I try to compile the code, I got
>> this kind of error:
>> 
>> v_of_rho.f90(546): error #6580: Name in only-list does not exist.   [ESM_HARTREE]
>>   USE esm,       ONLY: do_comp_esm, esm_hartree, esm_bc
>> 
>> The error seems to be that the compiler cannot recognize the subroutine
>> implemented in the generic way. Has anyone encountered the same sort of
>> problems? The version 11662 was uploaded this July, it would be very strong if
>> nobody had noticed it before. So I am suspicious that there is something wrong
>> in the setting of my compiler, but I could always compile the code except this
>> one. Could anyone help? Thank you very much!
>> 
>> Best,
>> ===================
>> Dr. Xiaochuan Ge (Giovanni)
>> Center for Functional Nanomaterials
>> Brookhaven national laboratory
>> ===================
>> 
>> 
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> 
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