I think you made everything ok.
You are limited by the memory access (50GB/s with DDR4-3200 memory).
The most recent Intel processors support DDR5 RAM, which boosts the
memory access from 50 to 77 GB/s. They should be significantly faster
under full load.
Fast memory is more important than cl
Dear wien2k user
i have installed the wien2k 21.1 in a laptop with following
configuration
CPU: 8-Core 11th Gen Intel Core i7-11800H (-MT MCP-) speed/min/max:
4265/800/4600 MHz Kernel: 5.11.0-40-generic x86_64
Up: 1h 28m Mem: 2414.9/15743.8 MiB (15.3%) Storage: 953.87 GiB (5.2% used)
Procs:
Dear wien2k users,
Our problem is solved. There is an error of
"space" in R_LIBS option.
Thanks for your responses.
with regards,
On Thu, Feb 13, 2014 at 12:12 PM, shamik chakrabarti wrote:
> Dear wien2k users,
>
>Thanks for your response. But still we have not ab
Dear wien2k users,
Thanks for your response. But still we have not able to solve the
problem.We are using recent version of compiler consists of both fortran
and mkl library: Composer_xe_2013_Sp1.1.106. We are using Red-Hat linux. We
are installing wien2k 13 and have set the following options:
If I search the net, I can find a linux library "-lpthread" and a mkl
thread library "-lmkl_intel_thread".
However, I cannot find a mkl thread library called "lmkl_lpthread.so" or
"-lmkl_lpthread". These libraries might not exist.
On 2/12/2014 3:40 PM, Peter Blaha wrote:
The message looks to
The message looks to me as if you have missed the "-" sign in front of the
-lmkl_lpthread statement in your linker or R_LIB line.
We are trying to install wien2k version 13 in our system. During
compilation we are getting stuck due to an error message:
*ld: can not able to find lmkl_
Excellent description, but I would suggest replacing ifortvars.sh (for
only ifort) with compilervars.sh (for ifort+mkl).
The standard method is to (before compilation) do
source COMPOSER_PATH/bin/ifortvars.sh CPUTYPE
where COMPOSER_PATH is where you put the compiler, and CPUTYPE is
either int
The standard method is to (before compilation) do
source COMPOSER_PATH/bin/ifortvars.sh CPUTYPE
where COMPOSER_PATH is where you put the compiler, and CPUTYPE is
either intel64 or ia32
For COMPOSER_PATH you can use the generic such as /opt/intel/composer
(which links to the latest version instal
try with these options. it may work.
current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -ip -O1 -traceback
current:LDFLAGS:$(FOPT)
-L/opt/intel/composerxe-2011.3.174/compiler/lib/intel64 -shared-intel
-lsvml -openmp -lpthread
current:DPARALLEL:'-DParallel'
current:R_LIBS:-L/opt/intel/composerxe-20
Dear Wien2k users,
We are trying to install wien2k version 13 in our system. During
compilation we are getting stuck due to an error message:
*ld: can not able to find lmkl_lpthread.so*
we have taken the following measure but get no success so far:
(1) checked the correctness of mkl librar
Choose I for the compiling option, download the attatched file for licence.
?
Good luck
Jameson
From: AJAY SINGH VERMA
To: wien zeus
Sent: Tuesday, 7 August 2012 11:14 AM
Subject: [Wien] compilation problem
sir
as? i have 12.1 version of compiler but
sir
as i have 12.1 version of compiler but it doesn't come in the option
ILinux (Intel ifort 12.0 compiler + mkl )
JLinux (Intel ifort 9 or 10 compiler + mkl 9.0 )
KLinux (Intel ifort 11.0 compiler + mkl )
K1 Linux (Intel ifort 11.1 compiler + mkl )
A
2 08:03
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] compilation problem
Choose I for the compiling option, download the attatched file for licence.
Good luck
Jameson
From: AJAY SINGH VERMA
To: wien zeus
Sent: Tuesday, 7 August 2012 11:14 AM
Subject: [Wien] compilation problem
sir
Please read the file compile.msg for the specifics of the errors. I expect
that you have not specified the mkl libraries correctly. Please check the
mailing list, particularly the Intel linking guide page.
Note, if you do not provide more information, nobody can help you. Also,
you should try and
Dear Wien users,
I have installed centos 6 in my pc and successfully installed the fortran
compiler as /opt/intel/composer_xe_2011_sp1/bin/ifort. But then when I
tried to install wien2k 11.1 version or less, it shows 27 errors in various
steps of lapw and others. Is there any specific reason why th
Dear MPG,
We will start with Dibya's i5 machine. I will get back to you with
suggestions later ok.
Prof.R.K.Thapa
Mizoram University
Aizawl INDIA
===
2012/2/7 Madhav Ghimire
> Dear Wien users,
> I have installed centos 6 in my pc and successfully installed the fortran
> compiler as
Please read the file compile.msg for the specifics of the errors. I expect
that you have not specified the mkl libraries correctly. Please check the
mailing list, particularly the Intel linking guide page.
Note, if you do not provide more information, nobody can help you. Also,
you should try and
Dear Maxim Rakitin,
Thank you for your nice advice. I compiled fftw again according
to your option, then compilation of WIEN was successfully
completed.
Regards
---
Hiroki Takahashi
hiroki_takahashi at mitsui-kinzoku.co.jp
Mitsui Mining & Smelting Co., Ltd.
--
Dear WIEN2k Users,
I am trying to install WIEN2k_10.1 on a cluster computer. But I
got an error in compiling lapw0_mpi. The error message is :
-
mpif90 -FR -w -mp1 -prec_div -pad -ip -DINTEL_VML -O3 -xP -DParallel -c
W2kinit.F
mpif90 -o lapw0_mpi cputim.o modules.o reallocat
Dear Hiroki Takahashi,
Have you performed configure/make/make install with ifort compiler?
It seems that you don't have appropriate libraries after installation of
the fftw suite. I used the following command to configure it:
./configure --prefix=$HOME/lib/fftw2 LDFLAGS=-L/share/mpi/mvapich/lib
meka Okoye
Chukwuemeka M I Okoye
Department of Physics and Astronomy,
University of Nigeria,
Nsukka.
Enugu State,
NIGERIA.
Phone: +234-7038766990
+234-8053310658
E-mail: okoyecmi at yahoo.com
--- On Mon, 5/10/10, Gerhard Fecher wrote:
From: Gerhard Fecher
Subject: Re: [Wien] Compilation prob
wien.ac.at
Betreff: [Wien] Compilation problem
Dear Wien users,
I am compiling Wien2k v9.2 on Mandriva 10.1 32-bit iso using Intel Compiler
11.1.
My current settings are:
O Compiler options: -FR -mp1 -w -prec_div -pc80 -pad -align -DINTEL_VML
-traceback
L Linker Flags: $(FOPT) -L/opt/intel/Com
Dear Wien users,
I am compiling? Wien2k v9.2 on Mandriva 10.1 32-bit iso using?Intel Compiler
11.1.
?
My current settings are:?
O Compiler options: -FR -mp1 -w -prec_div -pc80 -pad -align -DINTEL_VML
-traceback
L Linker Flags: $(FOPT) -L/opt/intel/Compiler/11.1/069/mkl/lib/32 -pthread
-i-static
__
>Von: wien-bounces at zeus.theochem.tuwien.ac.at
>[wien-bounces at zeus.theochem.tuwien.ac.at] im
>Auftrag von Roberto Iglesias [roberto at uniovi.es]
>Gesendet: Donnerstag, 17. Dezember 2009 19:35
>An: A Mailing list for WIEN2k users
>Betreff: Re: [Wien] Compilation problem
at
uniovi.es]
Gesendet: Donnerstag, 17. Dezember 2009 19:35
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] Compilation problem latest ifort/mkl/Ubuntu
Dear Gerhard and Roger, dear all
Before attempting to go back to the 11.0 compiler, I tried as Gerhard suggested
and follow the
n.ac.at
>[wien-bounces at zeus.theochem.tuwien.ac.at] im
>Auftrag von Roger E. Rink [rrink at ameslab.gov]
>Gesendet: Donnerstag, 17. Dezember 2009 14:17
>An: A Mailing list for WIEN2k users
>Betreff: Re: [Wien] Compilation problem latest ifort/mkl/Ubuntu
>
>All I can rec
ameslab.gov]
Gesendet: Donnerstag, 17. Dezember 2009 14:17
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] Compilation problem latest ifort/mkl/Ubuntu
All I can recommend is to go back to an 11.0 intel compiler. I've spent
several weeks trying to get the 11.1 to work with no luck. Your
pro
at uniovi.es]
Gesendet: Donnerstag, 17. Dezember 2009 11:15
An: WIEN2k Mailing List
Betreff: [Wien] Compilation problem latest ifort/mkl/Ubuntu
Dear all
I am trying to install Wien2k_09.2 on an Intel (R) Core(TM)2 QUAD Q9300 @2.50
GHz computer taht runs Ubuntu 9.10, using ifort 11.1.059 and mkl
Dear all
I am trying to install Wien2k_09.2 on an Intel (R) Core(TM)2 QUAD Q9300 @2.50
GHz computer taht runs Ubuntu 9.10, using ifort 11.1.059 and mkl 10.2.2.025
libraries. I followed mainly Gerhard Fecher's guide
(http://www.ghfecher.de/html/bandstructure.html). I added the path to the
libr
All I can recommend is to go back to an 11.0 intel compiler. I've spent
several weeks trying to get the 11.1 to work with no luck. Your
problems sound similar to the ones I was having (not finding the
library) and the only fix was to backstep. This was with a Red Hat
Enterprise Linux 64bit i
erjee [aruna_c at
vsnl.net]
Gesendet: Dienstag, 1. Januar 2008 07:03
An: wien at zeus.theochem.tuwien.ac.at; m_kanoun at mail.univ-tlemcen.dz
Betreff: [Wien] compilation problem of wien2k
Dear wien2k users,
Wishing everybody a very happy new year 2008. I am a rather new wien2k user of
version 03.
Dear wien2k users,
Wishing everybody a very happy new year 2008. I am a rather new wien2k user of
version 03. I am working with a machine which has intel pentium 4 as processor,
intel fortran 90 compiler - ifort and on redhat linux platform.
Used options are : -FR -w -mp1 -prec_div -pad -ipo -i
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