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ABINIT — Abinit

PAW atomic data files. Guide for new users. Support the ABINIT group. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu ta nekueb.lehcim-naej. And Yann Pouillon ( se.uhe ta nolliuop.nnay. Academic responsibility : Xavier Gonze. Powered by Plone and Python.

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ABINIT — Abinit | abinit.org Reviews

https://abinit.org

PAW atomic data files. Guide for new users. Support the ABINIT group. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu ta nekueb.lehcim-naej. And Yann Pouillon ( se.uhe ta nolliuop.nnay. Academic responsibility : Xavier Gonze. Powered by Plone and Python.

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coverage.abinit.org coverage.abinit.org

Coverage - ABINIT

Beuken libxc223 8.3.0/. Trunk 7.10.4-private/. Trunk 7.11.12-private/. Trunk 7.8.2-private/. Trunk 7.9.3-private/. Trunk 8.0.8-private/. Trunk 8.1.1-private/. Trunk develop 8.1.7/. Trunk develop 8.3.0/. Trunk develop 8.3.1/. Trunk develop 8.3.2/. Trunk doc-8.2.1 8.2.1/. Trunk hotfix-8.2.2 8.2.2/. Trunk release-8.2.0 8.2.0/.

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ABINIT Developer's Corner — ABINIT DEV

Build status 7.10. Build status 7.11. Important note: some documents might be available to logged-in users only, or are in preparation. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu@nekueb.lehcim-naej. And Yann Pouillon ( se.uhe@nolliuop.nnay. Academic responsibility : Xavier Gonze. Powered by Plone and Python.

INTERNAL PAGES

abinit.org abinit.org
1

New user guide — Abinit

http://www.abinit.org/doc/helpfiles/for-v7.10/users/new_user_guide.html

PAW atomic data files. Guide for new users. Help file for ABINIT. This file gives a beginner's introduction to the use of the ABINIT package. This file is distributed under the terms of the GNU General Public License, see abinit/COPYING or http:/ www.gnu.org/copyleft/gpl.txt. For the initials of contributors, see abinit/doc/developers/contributors.txt . Contents of new user guide:. The ABINIT executable : abinit. Other programs in the ABINIT package. Input variables to abinit. What does the code do?

2

ABINIT packages — Abinit

http://www.abinit.org/downloads/abinit-packages

PAW atomic data files. Guide for new users. Help file for ABINIT. Available versions of the code (and associated help files). Help files : installation notes. ABINIT v 8.0.8b. Specific bug fix release (production version). ABINIT v 8.0.8. ABINIT v 8.0.7. ABINIT v 8.0.6. Help files : installation notes. ABINIT v 7.10.5. ABINIT v 7.10.4. ABINIT v 7.10.2. ABINIT v 7.10.1. Help files : installation notes. ABINIT v 7.8.2. ABINIT v 7.8.1. Help files : installation notes. ABINIT v 7.6.4. ABINIT v 7.6.3.

3

Norm-conserving Pseudopotentials — Abinit

http://www.abinit.org/downloads/psp-links/pseudopotentials

PAW atomic data files. Guide for new users. Help file for ABINIT. LDA pseudopotential files :. For most of the elements in the periodic table, generated by A. Khein and D.C. Allan. For most of the elements in the periodic table. Another Web site with the Hartwigsen-Goedeker-Hutter pseudopotentials. Teter "extended norm-conserving" pseudopotentials. For selected elements (Troullier-Martins scheme). LDA core-hole pseudopotential files. For a few elements. GGA (PBE) pseudopotential files :. This file is dis...

4

Abinit

http://www.abinit.org/robodoc

PAW atomic data files. Guide for new users. Help file for ABINIT. ABINIT is a full-featured software package to calculate the ground state and response functions of crystals and molecules within the Density-Functional Theory framework, using plane waves and pseudopotentials. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu ta nekueb.lehcim-naej. Powered by Plone and Python.

5

Input variables — Abinit

http://www.abinit.org/doc/input-variables

PAW atomic data files. Guide for new users. Help file for ABINIT. For ABINIT v7.10. For ABINIT v7.8. For ABINIT v7.6. For ABINIT v7.4. For ABINIT v7.2. For ABINIT v7.0. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu ta nekueb.lehcim-naej. And Yann Pouillon ( se.uhe ta nolliuop.nnay. Academic responsibility : Xavier Gonze. Powered by Plone and Python.

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chimie-theorique.univ-fcomte.fr chimie-theorique.univ-fcomte.fr

Pôle de Chimie Théorique et Modélisation;

http://chimie-theorique.univ-fcomte.fr/Equipments.html

Les membres du Pôle de Chimie Théorique et Modélisation disposent de:. 1) Moyens de calculs:. Accès aux centres de calculs régionaux. Mesocentre de calcul de Franche-Comté. Http:/ meso.univ-fcomte.fr/. CCUB (centre de calcul de l'UB). Https:/ haydn2005.u-bourgogne.fr/dsi-ccub/. Accès aux centres de calculs nationaux. GENCI (CINES, IDRSI,.) :. Http:/ www.genci.fr/. 2) Une liste complète des logiciels de Chimie Quantique et de Modélisation Moléculaire disponibles. 3) Quelques Examples de. The CRYSTAL packa...

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Center for Physics of the University of Coimbra

http://cfisuc.fis.uc.pt/links.php

EMSL Basis Set Exchange.

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Mac OS X Applications A-C | Macs in Chemistry

http://www.macinchem.org/applications/a-c.php

Mac OS X Applications A-C. Aabel :- Data Analysis. Is a new, and recently updated high performance data management, processing, and charting application for Mac OS X. It provides a superb visual front-end to high-performance statistical data analysis. It has over 200 data presentation styles and is capable of handling very large data sets. There is a review of Aabel 3.0. Abinit :- Density Functional Theory. ACPC:- Virtual screening of molecules using electrostatics. ADF2016 :- Density Functional Theory.

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3D Visualization System VENUS

http://fujioizumi.verse.jp/visualization/VENUS.html

3D Visualization System VENUS. An earlier Web page giving enthusiastic publicity to VICS and VEND in Japanese is here. It is now obsolete but a valuable record of their development. 3D visualization programs, VICS and VEND. Structural data files for VICS. 3D data files for VEND. Graphic data files output by VICS and VEND. Super-fast program, PRIMA, for MEM analysis. ALBA for the MEP method. A Web site that serves for 3D visualization from files created with SCAT. Clear densities and S. The VENUS package ...

mabruno.weebly.com mabruno.weebly.com

Some links - Marco Bruno

http://mabruno.weebly.com/some-links.html

Some useful links . Associazione Italiana di Cristallografia (AIC):. Http:/ www.cristallografia.org/. International Union of Crystallography (IUCr): http:/ www.iucr.org/. Authors and Papers finder:. ISI Web of Knowledge. Authors and Papers finder: Scopus. Http:/ www.crisdi.unito.it. Software and Source codes:. ABINIT Home Page: http:/ www.abinit.org/. Http:/ www.crystal.unito.it/. QUANTUM ESPRESSO Home Page: http:/ www.quantum-espresso.org/. Http:/ www.fisica.uniud.it/ ercolessi/md/. Physics and Chemist...

phythema.ulg.ac.be phythema.ulg.ac.be

People - Phythema

http://www.phythema.ulg.ac.be/members

My main research objectives are in understanding and designing new magnetic multifunctional materials using first-principles methods. To that end I use the combination of the development of new theoretical methods for magnetism within the density functional theory and their use for the modelling of technologically appealing exotic material properties. Presently I'm developing new capabilities in the ABINIT. The main crystal systems I'm looking on are:. Nature 452, p. 732 (2008), Improper ferroelectri...

wannier-transport.org wannier-transport.org

Links - Wannier Transport

http://www.wannier-transport.org/wiki/index.php/Links

Useful links, without any aims of completeness, are reported below:. CNR, Istituto Nanoscienze, S3 Center. Marco Buongiorno Nardelli's group. European THeoretical Spectroscopy Facility, ETSF. Retrieved from " http:/ www.wannier-transport.org/wiki/index.php? This page was last modified on 9 October 2012, at 17:41. This page has been accessed 4,559 times.

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Dr. Philipp Plänitz

http://www.plaenitz.info/main_3.php

Report for my two month laboratory at the. Hahn-Meitner-Institut Section Silicon photovoltaics. March 2003, in german language). Poster for springmeeting of the. 8-12 March, 2004). You can download the abstract for the poster or the full poster it self in different versions). Abstract poster 2004.txt. Poster 2004.ps.gz. A0 - 6.1 MB). A3 - 3.5 MB). Diploma thesis in german language (September 2004). Poster for springmeeting of the. 27-30 March, 2006). Abstract poster 2006.txt. A0 - 700 KB). R Leitsmann, O...

cfc.fis.uc.pt cfc.fis.uc.pt

Center for Computational Physics

http://cfc.fis.uc.pt/links.php

EMSL Basis Set Exchange.

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ABINIT — Abinit

PAW atomic data files. Guide for new users. Support the ABINIT group. This file is distributed under the terms of the GNU General Public License, see http:/ www.gnu.org/copyleft/gpl.txt. This page is maintained by Jean-Michel Beuken ( eb.niavuolcu ta nekueb.lehcim-naej. And Yann Pouillon ( se.uhe ta nolliuop.nnay. Academic responsibility : Xavier Gonze. Powered by Plone and Python.

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Abinit's Computer blog

Learn Copmputer Hardware And Software problem solutions. Friday, February 3, 2012. Show Files Hidden by Virus. Here is the kit for show usb hidden file by Virus. Double click on usb show.exe. Click on Recovery the hidden files. Your files will Recovered. Tuesday, June 28, 2011. Can't connect PC to PC between winxp and win7. Make sure your cable configuration is cross over. Make sure your workstation are same. Download and install LLTD.EXE. It will help to connect PC to PC between winxp and win7. Go throu...

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