Dear users and developers
I'm trying to patch the 6.3-backports version with environ 1.0. I'm
not using 6.3-backports out of caprice: there was an issue with neb.x
used with lda_plus_u a few months ago, that was fixed in such version,
so I can possibly update to the current unstable release, if needed.
Now I need to perform NEB simulations with my system embedded in an
implicit solvation environment, and I need therefore to install the
ENVIRON plug-in. However, all I obtain if I follow the instructions
and recompile the code (on marconi@cineca) is
mpiifort -O2 -assume byterecl -g -traceback -nomodule -fpp -D__DFTI
-D__MPI -D__FFTW -D__ENVIRON
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//include
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//FoX/finclude
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//S3DE/iotk/include/
-I/cineca/prod/opt/compilers/intel/pe-xe-2017/binary/mkl/include
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//iotk/src
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//Modules
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//FFTXlib
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//LAXlib
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//UtilXlib
-I/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports//FoX/finclude
-I../ELPA/src -c tools_generate_functions.f90
tools_generate_functions.f90(44): error #6580: Name in only-list does
not exist. [NL]
USE gvect, ONLY : nl, nlm, ngm, gg, gstart
-------------------------------^
tools_generate_functions.f90(44): error #6580: Name in only-list does
not exist. [NLM]
USE gvect, ONLY : nl, nlm, ngm, gg, gstart
-----------------------------------^
tools_generate_functions.f90(59): error #6404: This name does not have
a type, and must have an explicit type. [NL]
auxg(nl(1:ngm)) = auxr(nl(1:ngm))
---------^
tools_generate_functions.f90(59): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
auxg(nl(1:ngm)) = auxr(nl(1:ngm))
---------^
tools_generate_functions.f90(59): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
auxg(nl(1:ngm)) = auxr(nl(1:ngm))
---------^
tools_generate_functions.f90(59): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
auxg(nl(1:ngm)) = auxr(nl(1:ngm))
---------------------------^
tools_generate_functions.f90(59): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
auxg(nl(1:ngm)) = auxr(nl(1:ngm))
---------------------------^
tools_generate_functions.f90(64): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------^
tools_generate_functions.f90(64): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------^
tools_generate_functions.f90(64): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------------------------^
tools_generate_functions.f90(64): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------------------------^
tools_generate_functions.f90(64): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------------------------------------------^
tools_generate_functions.f90(64): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
auxg(nl(1:ngm)) = auxg(nl(1:ngm)) * auxr(nl(1:ngm))
---------------------------------------------^
tools_generate_functions.f90(66): error #6404: This name does not have
a type, and must have an explicit type. [NLM]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
---------------------------^
tools_generate_functions.f90(66): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NLM]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
---------------------------^
tools_generate_functions.f90(66): error #7973: A numeric or LOGICAL
data type is required in this context. [NLM]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
---------------------------^
tools_generate_functions.f90(66): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
-----------------------------------------------------------^
tools_generate_functions.f90(66): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
-----------------------------------------------------------^
tools_generate_functions.f90(66): error #6514: Substring or array
slice notation requires CHARACTER type or array. [NL]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
--------------------------------------------------------------------------------------^
tools_generate_functions.f90(66): error #7973: A numeric or LOGICAL
data type is required in this context. [NL]
IF ( gamma_only ) auxg(nlm(1:ngm)) = CMPLX( REAL( auxg(nl(1:ngm))
), -AIMAG( auxg(nl(1:ngm)) ) ,kind=DP)
--------------------------------------------------------------------------------------^
compilation aborted for tools_generate_functions.f90 (code 1)
make[1]: *** [tools_generate_functions.o] Errore 1
make[1]: Leaving directory
`/marconi/home/userexternal/gmattiol/knl/QE/6.3-backports/Modules'
make: *** [mods] Errore 1
Can anybody suggest improvements?
Thank you in advance
Giuseppe
GIUSEPPE MATTIOLI
CNR - ISTITUTO DI STRUTTURA DELLA MATERIA
Via Salaria Km 29,300 - C.P. 10
I-00015 - Monterotondo Scalo (RM)
Mob (*preferred*) +39 373 7305625
Tel + 39 06 90672342 - Fax +39 06 90672316
E-mail: <[email protected]>
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