Cours universitaires

COURS de CRISTALLOGRAPHIE - P. PERIO - Laboratoire de Cristallographie et de Physique des Matériaux Université PARIS-SUD Centre d’ORSAY.

COURS de CRISTALLOGRAPHIE GEOMETRIQUE - J. PROTAS - Laboratoire de Minéralogie et Cristallographie. Université de NANCY

COURS de CRISTALLOGRAPHIE pour la CHIMIE et les MATERIAUX

F. THEOBALD - Université PARIS-SUD Centre d’ORSAY (service de publications "Paris XI Edition)".

Ouvrages généraux

LA STRUCTURE de la MATIERE : DU CIEL BLEU à la MATIERE PLASTIQUE - A. GUINIER - HACHETTE

Ouvrages spécialisés en Cristallographie

ELEMENTARY CRYSTALLOGRAPHY - Martin J. BUERGER - John Willey and Sons.

INTRODUCTION à la CRISTALLOGRAPHIE - M. VAN MEERSCHE / J. FENEAU-DUPONT  Université de LOUVAIN.

An INTRODUCTION to X-RAY CRYSTALLOGRAPHY - M.M. WOOLFSON - CAMBRIDGE.

ESSENTIALS of CRYSTALLOGRAPHY - Duncan McKIE / Christine McKIE / B. LACKWELL  Scientific Publications.

CRISTALLOGRAPHIE - D SCHARZENBACH - Presses Polytechniques Universitaires Romandes.

CRISTALLOGRAPHIE GEOMETRIQUE et RADIOCRISTALLOGRAPHIE- J.J. ROUSSEAU   Masson.

FUNDAMENTALS of CRYSTALLOGRAPHY - Edited by C. GIACOVAZZO - International Union of Crystallography - OXFORD UNIVERSITY PRESS (1992).

INTERNATIONAL TABLES for CRYSTALLOGRAPHY - Volume A

Published for the International Union of Crystallography.

Ouvrages spécialisés en diffraction

THEORIE et TECHNIQUE de la RADIOCRISTALLOGRAPHIE –A. GUINIER  Dunod.

X-RAY DIFFRACTION - B.E. WARREN - ADDISON-WESLEY PUBLISHING COMPANY.

NEUTRON DIFFRACTION - G.E. BACON - PRESS OXFORD (1975).

INTERNATIONAL TABLES for CRYSTALLOGRAPHY - Volume C.

INTRODUCTION OF THE THEORY OF THERMAL NEUTRON SCATTERING G. L. SQUIRES - CAMBRIDGE UNIVERSITY PRESS (1978).

POLARIZED NEUTRONS - W. GAVIN WILLIAMS - CLARENDON PRESS OXFORD  (1988).

Logiciels spécialisés en Diffraction

Lazy-Pulverix, K. YVON, W. JEITSCKO, E. PARTHE, Laboratoire de Cristallographie aux Rayons X, Université de Genève, 24 quai Ernest Ansermet, CH1211 GENÈVE 4, SUISSE.

Poudrix (pour Microsoft Windows 95 et NT), J. LAUGIER, B. BOCHU, INPG, Domaine Universitaire, BP 46, F38402 ST-MARTIN d’HÈRES, www.INPG.fr/LMGP.

Carine - Cristallographie 3.0 (pour Microsoft Windows 95 et NT), C. BOUDIAS, D. MONCEAU, 17 rue du Moulin du Roy, F60300 SENLIS. monceau@cict.fr.

LMGP Suite

The LMGP suite for Windows by Jean Laugier and Bernard Bochu contains a number of programs useful for crystallography, Laue Diffraction and Powder Diffraction.

Tutorial run-throughs for this suite are at : http://www.ccp14.ac.uk/tutorial/lmgp/

Obtaining and installing the LMGP suite

Just get the zip files for the programs you wish to use at

http://www.ccp14.ac.uk/ccp/web-mirrors/lmgp-laugier-bochu/)

and extract into any subdirectory on C-drive that takes your fancy. It is best to run the programs at not less than 1024x768 screen resolution. Though some of the programs can run at less than this.

If you use this software and publish results, the citation to use is :

LMGP-Suite of Programs for the interpretation of X-ray Experiments,

by Jean Laugier and Bernard Bochu,

ENSP/Laboratoire des Matériaux et du Génie Physique,

BP 46. 38042 Saint Martin d'Hères, France.

WWW: http://www.inpg.fr/LMGP    and http://www.ccp14.ac.uk/tutorial/lmgp/

OrientExpress - "The program Orient Express makes it possible to orient a single crystal of known unit cell dimensions from a single Laue pattern. This pattern can be registered on a flat or cylindrical detector :X Rays film, two-dimentional sensitive detector, bitmap picture. The program was succesfully applied to X rays (normal wavelength and hard X rays) and neutrons experiments, as well as to every sort(mineral, organic and protein) of crystals."

Equiv - given a space group: equivalent positions, extinctions/systematic absences, equivalent reflections are listed .Individual HKLs and atomic coordinates can be inserted to obtain this out put.

indx - given an input of the cell, spacegroup and wavelength, this program for calculates powder diffraction line positions, HKLs and multiplicities; as well as provide extinctions/systematic absence conditions.

celref - unit cell refinement and HKL calculation; overlaying the results on the raw data.

chekcell - graphical powder indexing helper tool that links into the Crysfire Powder Indexing suite by Robin Shirley.  http://www.ccp14.ac.uk/tutorial/crys/  Chekcell can also handle Celref  cry files and manually inputted cells.

truecell - From a given cell, this program searches more symetric multiple cells.  This can be useful where powder indexing programs favour small cell low symmetry cells - where a truer cell might be a higher volume higher symmetry cell. http://www.ccp14.ac.uk/tutorial/crys/ Truecell can also handle Celref cry files and manually inputted cells.

Poudrix - Powder Pattern Calculation of Synchrotron/Laboratory X-ray and Neutron Powder Diffraction Patterns including the ability to use Anomalous Dispersion co-effecients at all wavelengths.Poudrix also comes with the DISPANO program "Anomalous Scattering factor display software" which can display data according to "Brennan and Cowan" or Sasaki"

Wulff - Wulff Map generating software.

DISPANO  - "Anomalous Scattering factor display software" which can display  data according to "Brennan and Cowan" or Sasaki"