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Extending the reach of powder diffraction modelling by user defined macros : special topic volume with invited peer reviewed papers only /
The main focus of this special topic volume is the development and possibilities of the MACRO language within TOPAS, with a specific session dedicated to WPPM. The collection is presented here in the form of a ""macro tutorial"" for the benefit of the entire powder diffraction co...
| Clasificación: | Libro Electrónico |
|---|---|
| Otros Autores: | , |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Switzerland ; Trans Tech,
2010.
©2010 |
| Colección: | Materials science forum ;
v. 651. |
| Temas: | |
| Acceso en línea: | Texto completo |
MARC
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| 245 | 0 | 0 | |a Extending the reach of powder diffraction modelling by user defined macros : |b special topic volume with invited peer reviewed papers only / |c edited by Paolo Scardi and Robert E. Dinnebier. |
| 246 | 3 | |a Extending the reach of powder diffraction modeling by user defined macros | |
| 260 | |a Switzerland ; |a Trans Tech, |c 2010. | ||
| 264 | 4 | |c ©2010 | |
| 300 | |a 1 online resource (v, 219 pages) : |b illustrations | ||
| 336 | |a text |b txt |2 rdacontent | ||
| 337 | |a computer |b c |2 rdamedia | ||
| 338 | |a online resource |b cr |2 rdacarrier | ||
| 490 | 1 | |a Materials science forum, |x 0255-5476 ; |v v. 651 | |
| 504 | |a Includes bibliographical references and index. | ||
| 505 | 0 | |a Advanced Input Files & Parametric Quantitative Analysis Using Topas -- Problem Solving with the TOPAS Macro Language: Corrections and Constraints in Simulated Annealing and Rietveld Refinement -- Robust Refinement as Implemented in TOPAS -- In Situ Diffraction Studies: Thermal Decomposition of a Natural Plumbojarosite and the Development of Rietveld-Based Data Analysis Techniques -- Molecular Motion by Refinement of TLS Matrices from High Resolution Laboratory Powder Diffraction Data: Implementation in the Program TOPAS and Application to Crystalline Naphthalene -- Simulated Annealing Approach for Global Minimum Verification in Modeling of Pressure-Volume Dependence by Equations of State Obtained by High-Pressure Diffraction -- Direct Access to the Order Parameter: Parameterized Symmetry Modes and Rigid Body Movements as a Function of Temperature -- "Powder 3D Parametric": A program for Automated Sequential and Parametric Rietveld Refinement Using Topas -- MEM Calculations on Apatites Containing Peroxide Using BAYMEM and TOPAS -- Protein Powder Diffraction Analysis with TOPAS -- Composition-Induced Microstrain Broadening: From Pattern Decomposition to whole Powder Pattern Modelling Procedures -- WPPM: Microstructural Analysis beyond the Rietveld Method -- WPPM: Advances in the Modeling of Dislocation Line Broadening -- Domain Size Analysis in the Rietveld Method -- The Application of the Fundamental Parameters Approach as Implemented in TOPAS to Divergent Beam Powder Diffraction Data. | |
| 588 | 0 | |a Print version record. | |
| 520 | |a The main focus of this special topic volume is the development and possibilities of the MACRO language within TOPAS, with a specific session dedicated to WPPM. The collection is presented here in the form of a ""macro tutorial"" for the benefit of the entire powder diffraction community. More than a collection of standard scientific papers, the contributions to this special issue provide methods, tutorials and practical suggestions and solutions for the proper use of TOPAS and WPPM in a number of applications; ranging from the most common to the most refined and specific cases. Readers will fi. | ||
| 590 | |a eBooks on EBSCOhost |b EBSCO eBook Subscription Academic Collection - Worldwide | ||
| 650 | 0 | |a Diffraction |x Mathematics. | |
| 650 | 0 | |a Diffraction |x Computer simulation. | |
| 650 | 6 | |a Diffraction |x Mathématiques. | |
| 650 | 6 | |a Diffraction |x Simulation par ordinateur. | |
| 650 | 7 | |a SCIENCE |x Physics |x Optics & Light. |2 bisacsh | |
| 700 | 1 | |a Scardi, P. |q (Paolo) | |
| 700 | 1 | |a Dinnebier, Robert E. | |
| 776 | 0 | 8 | |i Print version: |t Extending the reach of powder diffraction modelling by user defined macros. |d Switzerland : Trans Tech, 2010 |w (OCoLC)646393527 |
| 830 | 0 | |a Materials science forum ; |v v. 651. | |
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