No, there is no way to reduce the SO effect by an input parameter.
Of course you can modify SRC_lapwso and recompile.
The speed of light is defined in modules.F, where it is set as a parameter.
modules.F: REAL*8,PARAMETER :: CLIGHT=137.0359895D0
You can change it there and recompile.
Obviousl
Sir,
I am Vivek Pandey, a Ph.D. student. I am running wien version
WIEN2k_21.1 on a HPC cluster with operating system CentOS Linux 7 (Core).
The Fortran compiler being used is GNU Fortran (GCC) 4.8.5 20150623 (Red
Hat 4.8.5-44).
I want to study the effect of the strength of spin-orbit c
At the end, only a benchmark can tell.
These are a bit older processors, but they have the advantage of 4
memory channels (instead of 2). Since we know that when all cores are
used, the speed is limited by the memory, it could well be that they are
faster in these cases (and usually, due to pa
lapw1 benchmarks (autocorrect)
--
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and to think what
nobody else has thought" Albert Szent-Györgyi
On Sun, Sep 26, 2021, 11:
Can you ask your vendor to benchmark the speed, e.g. using the laptop
benchmarks? That is great most accurate method.
--
Professor Laurence Marks
Department of Materials Science and Engineering
Northwestern University
www.numis.northwestern.edu
"Research is to see what everybody else has seen, and
Can an X-series processor like i9-10900x or i9-9900x with larger memory
bandwidth (94 GB/s and 85GB/s
vs 50GB/s for i9-11700k and i7-10700k) but slower RAM DDR42933 make faster
calculations.
Sandeep Arora
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I'd go for a 8 core processor of the 11. generation like
I9--11900K or I7-11700K
which support already the faster DDR4-3200 RAM.
I'd also configure 64 GB RAM and besides the SSD an additional 2TB disk
(7/24 duty - i.e. made for continous use).
Am 26.09.2021 um 10:12 schrieb SANDEEP ARORA:
De
Dear wien2k user,
we are planning to purchase a system for
working on monolayer semiconductors consisting of 30 to 50 atoms in
supercell. We can't afford to purchase a cluster.
can we go for a system with I7-10870h processor Ram 32gb ssd 1tb.
Any suggestions would be a
Thanks a lot Prof. Laurence Mark and Delamora.I will study more and report
back if there is any problem.
With kind regards.
Lawal
On Monday, April 29, 2019, 1:27:18 AM GMT+8, Laurence Marks
wrote:
To generate such a superstructure you need to work out (aided by experiment)
the re
To generate such a superstructure you need to work out (aided by
experiment) the relevant epitaxial relationship between the two, then
create the appropriate nxm 2D semicoherent interface and extend in the
third direction to a periodic structure.
This is a complex problem in bicrystallography. If
I suppose that you have TiO2 rutile, and ZnO rocksalt, so what do you mean by
one layer?
Also, they have very different unit cell parameters TiO2; 4.57, 4.57, 2.93,
ZnO; 3.81, so how can you put them one on top of the other?
Let me rewrite the question. We want t
Thanks a lot Prof. Delamora for your reply.
Let me rewrite the question. We want to make a heterostructure of TiO2/ZnO,
just two layers for now. Your response is highly appreciated.
Kind regards
Lawal
On Sunday, April 28, 2019, 7:01:09 AM GMT+8, delamora
wrote:
#yiv7308072348 P {ma
Dear Developers and Users,
I need your help to generate unit cell of a semiconductor structure of two
layers of different materials. Any hint is highly appreciated.
Your question is not clear... There are many possibilities
Do you want to put two layers? What
Dear Developers and Users,
I need your help to generate unit cell of a semiconductor structure of two
layers of different materials. Any hint is highly appreciated.
Thanks a lot for your time.
With kind regards.
Lawal
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cif2struct is most likely ok, but since you did not send cif and struct
files, nobody can check it.
Yes, for C2/c cif2struct will interchange Y-Z; don't worry. Wien2k
supports only one of the many equivalent settings.
On 2/26/19 8:15 AM, Enamul Haque wrote:
Dear Dr. Peter Blaha (sir) and exp
Dear Dr. Peter Blaha (sir) and experts,
I have tried to import a cif file of experimental structure with space group
C2/c(#15) by using cif2struct script. This script interchanged Y-Z (Beta into
gamma) for Monoclinic lattice. I have tried to fixed it my manually but
initialization was failed. Is
Dear Prof. Blaha and Wien2k users,
I want to estimate Ueff for the Mn atom (3d5) using the method
described by Georg
K. H. Madsen and Pavel Novak
For E3d (+ 1 / 2e) (I have no problem) and configuration is;
Up Dn
.
3, 2, 4
One of the best approach is to do a SCF calculation for a small number
of k-points and then increase gradually this number.
Then you plot the total energy as a function of the number of k-points
and you will choose the smallest number giving rise to a good convergency.
Ideally you should do s
The number of k-points depends on your structure. Please have a look at
the FAQs:
http://susi.theochem.tuwien.ac.at/reg_user/faq/kgen.html
Am 01/02/2017 um 12:09 schrieb GM RAI:
Dear Wien2k User,
How can we select number of k-points for best convergence?
Regards
--
Dr. G. Murtaza
___
Dear Wien2k User,
How can we select number of k-points for best convergence?
Regards
--
Dr. G. Murtaza
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s of Solids
01187 Dresden
Von: wien-boun...@zeus.theochem.tuwien.ac.at
[wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von Rishi Singh
[rishising...@gmail.com]
Gesendet: Dienstag, 26. April 2016 04:23
An: A Mailing list for WIEN2k users
Betreff: Re: [Wien] need help
Thank u Dr Bhamu.
I want t
@gmail.com]
Gesendet: Freitag, 29. April 2016 07:38
An: A Mailing list for WIEN2k users
Betreff: [Wien] Need Help
Dear Wien and boltztrap users
Good morning.
I am working with boltztrap. I have installed it successfully. I have
a folder named LaMgTl. I have the following files in LaMgTl folder:
.ac.at] im Auftrag von Rishi Singh
[rishising...@gmail.com]
Gesendet: Freitag, 29. April 2016 07:38
An: A Mailing list for WIEN2k users
Betreff: [Wien] Need Help
Dear Wien and boltztrap users
Good morning.
I am working with boltztrap. I have installed it successfully. I have
a folder named LaMg
Dear Wien and boltztrap users
Good morning.
I am working with boltztrap. I have installed it successfully. I have
a folder named LaMgTl. I have the following files in LaMgTl folder:
boltztrap (an executable file), x_trans, case.struct,case.energy and
case.intrans with auitable values. Case mean
Max Planck Institute for Chemical Physics of Solids
> 01187 Dresden
>
> Von: wien-boun...@zeus.theochem.tuwien.ac.at
> [wien-boun...@zeus.theochem.tuwien.ac.at] im Auftrag von Rishi Singh
> [rishising...@gmail.com]
> Gesendet: Dienstag, 26. April 2016 04
etreff: Re: [Wien] need help
Thank u Dr Bhamu.
I want to know mostly about lower three points.
Kind regard
Dr rishi
On 4/25/16, Dr. K. C. Bhamu wrote:
> Dear Rishi
>
> I dont know about below input but at the top:
> 0.38314 (it if fermi energy from case.scf) 0.0005 (unchanged) 1.
Thank u Dr Bhamu.
I want to know mostly about lower three points.
Kind regard
Dr rishi
On 4/25/16, Dr. K. C. Bhamu wrote:
> Dear Rishi
>
> I dont know about below input but at the top:
> 0.38314 (it if fermi energy from case.scf) 0.0005 (unchanged) 1.0
> (unchanged) 120.0 (number of valence
Dear Rishi
I dont know about below input but at the top:
0.38314 (it if fermi energy from case.scf) 0.0005 (unchanged) 1.0
(unchanged) 120.0 (number of valence electrons from case.scf file)
Sincerely
Bhamu
Dr. K. C. Bhamu
(UGC-Dr. D. S. Kothari
Dear wien users
I am interested to calculate the transport properties using BoltzTrap
via wien2k.
I installed Bolztrap successfully. When we run it in a folder we need
some values (given below) for a file named case.intrans which is
necessary. Plz help me by telling that from which files we Can fi
I wonder what is the k-mesh in the supercell that you use to get the path after
unfolding?
Also, fold2Bloch will bring the k-points after unfolding in the range (-0.5,
0.5].
> (1/4 1/2 3/4) W
This cannot be found in the output since 3/4 > 0.5
> (0 1/2 1/2) X
> (-1/4 1/2 1/4) W
This should be
I sent the figure to your e-mail that includes what I'm saying.
My structure is 2:2:2.
I can get the band structure from G to L or G to X.
I set the vector
(0 0 -1/2)
(0 0 0)
(0 0 1/2)
(1/2 1/2 0)
(-1/2 -1/2 0)
But, I can't get the band structure from W to L or W to X with fold
Am I understand correctly that you expect the K point (0 0 0.5) to transform
into (-0.375 0 0.375) after unfolding?
What is the size of the supercell?
Oleg
> On Feb 1, 2016, at 10:32, Yongbeom Cho wrote:
>
> Dear all,
>
> I want to unfold the bandstructure from K to K' in fcc
> (-0.375 0 0.
Dear all,
I want to unfold the bandstructure from K to K' in fcc
(-0.375 0 0.375) <= K
(0 0 0.5)<= K'
Can fold2Bloch unfold this band?
Best ragards,
Yongbeom Cho
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Thanks for bringing this issue up. I made modifications to the MATLAB
script that plots the unfolded band structure. It contains now a variable
FOLDS = [1 2 3] that represents an arbitrary multiplicity selected when
constructing a supercell. The updated script is located at
https://github.com/rubel
Resp. Karel Vyborny
Thanks sir for the reply,
Regards
Sikander
On Thu, Jan 21, 2016 at 2:16 AM, sikander Azam
wrote:
> Resp. Gavin Abo
> Thanks sir for the reply, I got the point.
> Regards
> Sikander
>
> On Thu, Jan 21, 2016 at 1:02 AM, Gavin Abo wrote:
>
>> If you have the calculated rho/tau
Resp. Gavin Abo
Thanks sir for the reply, I got the point.
Regards
Sikander
On Thu, Jan 21, 2016 at 1:02 AM, Gavin Abo wrote:
> If you have the calculated rho/tau from BoltzTraP, (rho/tau)_calculated,
> and the experimental conductivity, rho_experimental, you could use the
> equation given in th
This recipe should be taken with caution though. It effectively relies on
a single band picture of transport. In reality, relaxation times can
(and typically are) different for different bands crossing the Fermi
level. The plasma frequencies for individual bands should then be weighted
with the
If you have the calculated rho/tau from BoltzTraP, (rho/tau)_calculated,
and the experimental conductivity, rho_experimental, you could use the
equation given in the "How can I calculate the conductivity" in the "1.3
Frequently Asked Question" section of the BoltzTraP UserGuide to
estimate what
Dear All
How i can obtain the value of tau from my calculated electronic
conductivity and from the experimental electronic conductivity.
Regards
Azam
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Hi. Thanks for reading this.
I want to calculate the effective mass from the band structure with fold2Bloch
data.
I used the parabolic approximation method to calculate effective mass.
So, I need band structure which is proper to get effective mass (same ratio of
the band width is required)
Eve
It does NOT make sense to apply U to delocalized Ge s and p states.
Some people have used it for the low lying Ge 3d states, but I doubt
that this is the proper way to do a calculation.
Am 08.01.2016 um 16:29 schrieb Yongbeom Cho:
Hi, all
I have some questions about the orbital dependent pot
you may try reproducing the NiO results by Novak madsen...use userguide and
the instructions together for the selection of patameters in calculation..
it should be possible...
On 08-Jan-2016 9:00 pm, "Yongbeom Cho" wrote:
> Hi, all
>
> I have some questions about the orbital dependent potential.
Hi, all
I have some questions about the orbital dependent potential.
To optimize Ge’s volume, I’ve heard that LDA+U needs to be applied.
So I want to set the input file “.inorb”
I had put the values that are related with orbital into the input
file “.inorb”.
I know that peripheral electrons i
Dear Wien2k users,
I want to run DMFT for highly correlated material. So, I wanted to install
TRIQS. I havve installed python. which python returns the appropriate
python file location. (see below)
(.my_python)linux-poo0:~/triqs.build # which python
/root/.my_python/bin/python
However TRIQS ins
Resp sir Gavin abo
Thanks a lot sir.
Regards
Sikander
On 26 Oct 2015 17:01, "Gavin Abo" wrote:
> See:
>
> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg09303.html
> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg06270.html
>
> On 10/26/2015 9:19 AM, sikander A
See:
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg09303.html
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg06270.html
On 10/26/2015 9:19 AM, sikander Azam wrote:
Dear All
Please help me that how to solve the following problem
Error in LAPW2
'l2main' - QTL
Dear All
Please help me that how to solve the following problem
Error in LAPW2
'l2main' - QTL-B.GT.15., Ghostbands, check scf files
Regards
Sikander
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Dear User
I am confused, that in the LAPW method the potential is spherically
symmetric potential in the Muffin-tin region while in the FPLAPW method the
potential is not spherically symmetric?
please explain it.
Regards
Sikander
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Wie
Hello Youngboem,
it would be useful to include the band structure plots from your attempts.
Otherwise it is hard to guess what went wrong.
Also, before plotting, it will be helpful to look at a part of the output that
contains the Bloch spectrum weights for the conduction band maximum and the
Clearly your solution isfold2bloch.
If you don't like the plot, you have to modify this part yourself and
make a different plot, but fold2bloch captures all the relevant physics
which happens due to doping. Doping may lead to a "broadening" of bands
when you introduce alloying (and represe
Hi. I can solve many technical problems by all your helps. Thank you
very much..!
Now new problem emerged in front of me.
Very simple problem but unfortunately, it's too hard to solve for me.
"How can I unfold the band structure made in 2x2x2 or some structure by
'supercell'? (without fold2bloc
Hi. i have used wien2k for two months. (version of 14.2)
my machine has 8-core CPU composed of 18 threads with 64Gb memory.
so i had my machine execute lapw on parallel.
i set .machines as below.
---
1:localhost
1:localhost
1:localhost
1:localhost
1:localhost
1:localhost
1:localho
What you described is called unfolding the supercell band structure. fold2Bloch
package can do it for you once the Wien2k supercell calculation is completed.
Please see “Unsupported software goodies” at
http://www.wien2k.at/reg_user/unsupported/
I hope it will help
Oleg
> On Aug 25, 2015, at 7
Dear all.
Hi. i'm a newbie to WIEN2k. i'm a college student majoring in electronic
engineering.
I purchased a new computer to use WIEN2k effectively. ;8 core CPU and
64Gb memory.
I've been interested in band structures. nowadays, i'm totally hooked on
alloy.
but, i encountered a barrier. it ap
Resp. AllIn calculation I am facing the following problem, please help me.
Error in lapw2'FERMI" -# of k-points in up and down not equal:'FERMI" -k1, 224
225 check INPUTS OF LAPW1
With best regardssikander
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Did you do a bandstructure calculation (i.e., x lapw1 -band [-up/-dn])
just before doing the BoltzTraP calculation? I think that is why the
factorization error usually happens. However, you need to do the
BoltzTrap calculation directly after the scf calculation , which has no
'-band', (i.e., x
Hi Gavin
Thank you,
It helped and I am able to run Boltztrap, however I get factorization
error. Even as I attempt with the highest possible K points, same error
continues...
Could you advice
On Thu, Jan 22, 2015 at 2:26 PM, Gavin Abo wrote:
> It does sound like a problem with the settin
It does sound like a problem with the setting of the environment. You
should consult your operating system documentation on how to set the
environment so that it can find the libblas.so.3gf on your system.
Usually, that involves setting an environmental variable in .bashrc or
setting a locati
Dear Wien2k users,
We are using Wien2k 13.1 version through W2Web feature. We have been using
Wien without much issues. Now we wanted to implement BoltzTraP code (VER
V1.2.5) for studying the thermo electric properties.
We have installed BLAS and LAPAK in our Suse based system. When we try
runnin
Hi,
Maybe. 34 atoms with WIEN2k is not a cheap calculation. To eventually
speed up the calculation, you have to consider two things:
1) Are you not using parameters (e.g., size of basis set, k-mesh, etc.)
which are set to values that are more than what you really need?
I'm thinking about the k-m
Dear Developers and users,
I am a new user of wien2k, I got a problem, I am running SCF calculation for 7
days, but only four cycles was achieved. Where my compound have 34 atoms.
My question is this normal?
Any response is appreciated.
With regards
Ahmed Subhi Jbara
Physics Department
Hi Khan,
Did you apply x patchsymm?
All the best,
Luis
2014-04-15 6:21 GMT-03:00 kalsoom Khan :
> Dear all
> I am making the supercell but when i doped an atom.. i get this problem
>
> ERROR: (multiplicity of atom 20 )*(number of
> pointgroup-operations)
>
Dear all
I am making the supercell but when i doped an atom.. i get this problem
ERROR: (multiplicity of atom 20 )*(number of pointgroup-operations)
ERROR: is NOT = (number of spacegroup-operations)
ERROR: MULT: 2 ISYM: 2 NSYM 2
ERROR: Check your struct
Look at page 117 of the UG:
http://www.wien2k.at/reg_user/textbooks/usersguide.pdf
Usually, we don't need to care about Gmax since 12 is good enough in
most cases.
On Mon, 10 Mar 2014, kalsoom Khan wrote:
Dear All
Why we use Gmax=12 in our calculation, Please explain me what it means,
(i.e. i
Dear All
Why we use Gmax=12 in our calculation, Please explain me what it means, (i.e. i
don't know the Gmax)
With regards
kalsoom___
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Dear Dr. H.A.Rahnamaye Aliabad,
Thank you for your help. I did that, but still I am having issues. I was
prompted to
give x and y-offset scaling factors (in units of d12)
The question is that I don't know what x and y-offset scaling factors are. If
you can explain further I will be grateful.
Dear Lawal,
You have to run in Terminal as a separate command.
Yours,
Rahnama
Dr. H.A.Rahnamaye Aliabad,
Assistant Professor,
Department of physics,Hakim Sabzevari University,
Sabzevar,Iran
Tel:+98-571-4003155
Fax:+98-571-4411161
Academic email:rahn...@hsu.ac.ir
On Wednesday, January 8, 2014 8
Dear Developers and users,
I have got a problem. I am using wien2k 11 version. I don't know where to
locate rhomb_in5 program in w2web. Can someone please help on how to use the
program?
Regards
Lawal
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Dear Khan,
Take a look on section 12 (Trouble Shooting) of the User's Guide. It
will give you some hints on this problem.
Good luck !
Luis
2013/11/7 kalsoom Khan
> Respected all
> I am runing the scf for mBJ but this give me the error "x lapw1.error"
> when i checked that e
Respected all
I am runing the scf for mBJ but this give me the error "x lapw1.error"
when i checked that error so this was written
** Error in Parallel LAPW1
** LAPW1 STOPPED at Wed Apr 10 19:29:04 CEST 2013
** check ERROR FILES!
Error in LAPW1
'SELECT' - no energy limits found for L= 1
'SE
You have a very nice explanation in the USERGUIDE at the LAPW1 section.
RKMAX is the product between the smallest RMT in your case.struct file
and KMAX (plane wave basis set).
If you have a standard structure (without hydrogen atoms or small atoms)
RKMAX = 7 is fine in general.
If you have hydro
Dear All
please help me that what the parameter RMTKMAX mean? And why this parameter
RMTKMAX is equall to 7?
with regards
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Dear sir,
Kindly help me to understand some of the parameters of the Bolztrap input
file in the user guide.
In the 2nd line from the bottom in , i have seen a parameter
which is described in a short sentence as "number of fixed doping". Is this
means, we are choosing the number of doping concen
Dear Gavin,
thanks for your prompt reply,
To make sure whether 3rd column is indicating the size/fatness of the
bands, i create the case.insp with two different input configurations in
line number # 11. (keeping all are same except line # 11)
As specified in the case.insp file line number # 11,
Dear Wein2k users,
i have successfully runs the Spaghetti calculations after getting spin
polarized scf convergence using following commands for 16 atomic based
primitive unit cell,
x lapw1 -band -c up/dn
x irrep -up/dn
x lapw2 -band -qtl -c -up/dn
Edit case.insp
x spaghetti -up/dn
I need cl
19.02.2013 09:22, idris.09 idris wrote:
> I am not able to install Wien2k 12 on ubuntu.
> i want to install wien2k 12 on my laptop in ubuntu. i have downloaded
> intel composer latest version. could u help me by giving some tips. i
> have already tried but failed.
Dear Idris,
I have tried to help
dear wien2k users
I am not able to install Wien2k 12 on ubuntu.
i want to install wien2k 12 on my laptop in ubuntu. i have downloaded intel
composer latest version. could u help me by giving some tips. i have
already tried but failed.
-- next part --
An HTML attachment was s
The procedure you describe is absolutely correct, but one word of warning:
I have not checked experimental papers, but if they say Co2MnAl has SG 225
it can only mean that Mn and Al are disordered, i.e. both have an occupancy
of 0.5 (at each of the "8c" positions). Something like this cannot be us
Dear user of wien2k i need help as i am not able to define a structure file
for full heusler alloy X2YZ (space group 225) type structure. where x is at
(000) and (1/2,1/2,1/2, ). Y atoms at (1/4,1/4,1/4) and Z atoms occupy
(3/4,3/4,3/4) positions. when i define these positions and click to view
str
Someone, please correct me if I'm wrong.
For example, let full heusler Co2MnAl with 225 spacegroup be:
a = b = c = 5.694 angstrom
alpha = beta = gamma = 90 deg
Co (0,0,0) and (0.5,0.5,0.5)
Mn (0.25,0.25,0.25)
Al (0.75,0.75,0.75)
In StructGen, spacegroup 225 is selected. Then, the following is u
The third line of case.intrans lets you specify the range of values for the
chemical potential. If the third line starts with "0.0 0.01 0.25" then it
will calculate the transport properties for a chemical potential of 0.0 +/-
0.25 in increments of 0.01 and this will be given in the 1st column of
c
* Dear Gregory Pomrehn* and all wien2k users,
Thank you so much for kind and quick reply. My last question was that, As
you know in case.trace file there is lots of data in which all transport
coefficient are given in different column in given temperature range. So
my question is that which data
Respected G. K. H Madsen Sir and All Wien2k Users,
I am trying to compute Transport properties by using BoltzTrap code. I have
successfully installed this code. When I tried for run test for CoSb3 I
got case.trace, case.condtence file and case.halttence etc. file in which
output is written. I am
In this case Ef (Fermi energy) and chemical potential (mu) are synonymous
and s/T probably stands for Sigma/Tau. The data in each column is as you
would expect.
NOCALC can be used if you are restarting a calculation and can read the
expansion coefficients from file.
I don't understand your last
Dear Gavin Abo, SANJAY KUMAR SINGH and WIEN2k users,
The reference
http://zeus.theochem.tuwien.ac.at/pipermail/wien/2011-November/015788.html
that I have wrote is for 64-bit version, and if one want to install on
32-bit system,
use gcc instead of icc, or it would be failed.
Please note that the
here I am providing you my .bashrc and compilation options.
BABEL_DIR=/root/Babel/babel-1.1
export BABEL_DIR
#
PATH="/opt/intel/Compiler/11.1/072/bin/intel64:${PATH}"
PATH="/opt/intel/Compiler/11.1/072/mkl/tools/environment/mklvars64.sh:${PATH}"
#
MANPATH="/opt/intel/Compiler/11.1/072/ma
Respected Prof. Peter Blaha and all wien2k users,
I am installing wien2k on Ubuntu 10.04 LTS 64 bit. The FORTRAN composer XE
2011 update 1 has been installed.
I am installing on Dell inspiron N4110 Intel((R) core(TM) i3 2330M CPU @
2.2 GHz 3 GB RAM 64 bit operating system.
Can any one guide me t
Update 3 rather than 1 is suggested.
For update 3 (or update 1) installed in the default location, set the
environmental variables for ifort and mkl with the following line in
your .bashrc for 64-bit:
source /opt/intel/composerxe-2011/bin/compilervars.sh intel64
Only if you are using Intel's i
Respected All wien2k users,
First of all Happy new Year and Happy makar sankaranti.
May I request you to kindly help me to install wien2k ?
I recently purchased a Dell core i3 laptop 64 bit. Now I want to install
wien2k on this laptop.
I want to install wien2k on ubuntu. Which version of ubuntu
*Ubuntu 10.04 Long Term Support - 64 bit version*:
http://www.ubuntu.com/download/ubuntu/download
Note: Intel Fortran Composer XE with latest Ubuntu 11.10 is unsupported,
you can use at your own risk.
*For IFC and MKL, Intel Fortran Composer XE update 3 (or 4) is recommend
for "Intel processor
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