Search found 8 matches

by moones
Fri May 01, 2015 5:44 am
Forum: Other tools and postprocessing in ABINIT
Topic: band structure visualization
Replies: 5
Views: 6086

Re: band structure visualization

Your problem will be solved by installing the package:

sudo apt-get install python2.7 python2.7-dev
sudo apt-get install python-numpy python-scipy python-matplotlib
by moones
Fri May 01, 2015 5:24 am
Forum: Many-body perturbation theory
Topic: GW
Replies: 1
Views: 2969

Re: GW

Dear Bewar

1: You can do convergence study for your results.

2: May be results of bethe_salpeter calculation closer to the experimental data, and GW need to be corrected.

Best regards
moones
by moones
Fri May 01, 2015 5:18 am
Forum: Many-body perturbation theory
Topic: GW memory
Replies: 1
Views: 3148

Re: GW memory

Dear reinaldo-z
if you use gwmem=0 is better for you
to reduce requirement memory.
by moones
Fri May 01, 2015 4:07 am
Forum: Configuring and compiling ABINIT
Topic: How to use maximum power of my system
Replies: 2
Views: 4529

Re: How to use maximum power of my system

Dear Hamed
You can use parallel computation in abinit to use all cores.

best regards
moones
by moones
Tue Aug 26, 2014 8:57 am
Forum: Python interfacing : Abipy ecosystem
Topic: help for install Abinitgui
Replies: 4
Views: 15238

help for install Abinitgui

Dear all users
i'm trying install Abinitgui

in the 6th stage of the installation python_install.txt:

6) Setup configuration file $HOME/.abinit/abipy/abipyrc

I do not understand what should I do?
can you help me?

thanks a lot
by moones
Sat Aug 23, 2014 5:20 pm
Forum: Configuring and compiling ABINIT
Topic: Error undefined to `ATL_dscal' , ... in build abinit [SOLVED]
Replies: 4
Views: 5592

Re: Build error for abinit-7.6.1 [SOLVED]

thank you for all your help

with this command my problem was resolved:
sudo apt-get remove libopenblas-base
because i have more than one provider of BLAS/ATLAS/LAPACK installed <by the search I realized>

i have an abinit.7.8.2 installed package now :)

thanks a lot ;)
by moones
Wed Aug 20, 2014 4:40 am
Forum: Configuring and compiling ABINIT
Topic: Error undefined to `ATL_dscal' , ... in build abinit [SOLVED]
Replies: 4
Views: 5592

Re: Build error for abinit-7.6.1 [SOLVED]

i'm trying to instal abinit-7.8.2, but there is a same error. before instal abinit, i install these packages: sudo apt-get -y install gcc g++ gfortran sudo apt-get -y install patch sudo apt-get -y install libetsf-io-dev sudo apt-get -y install libnetcdf-dev sudo apt-get -y install libfftw3-dev sudo ...
by moones
Tue Aug 19, 2014 5:03 pm
Forum: Configuring and compiling ABINIT
Topic: Error undefined to `ATL_dscal' , ... in build abinit [SOLVED]
Replies: 4
Views: 5592

Error undefined to `ATL_dscal' , ... in build abinit [SOLVED]

Dear users I'm trying to install abinit-7.6.1 but after make there are following errors can you help me? thank you Making all in mods make[3]: Entering directory `/home/my/Documents/test/abinit/src/mods' There is no buildable file here make[3]: Leaving directory `/home/my/Documents/test/abinit/src/m...