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Journal of Applied Crystallography, ISSN 1600-5767, 10/2010, Volume 43, Issue 5‐1, pp. 1126 - 1128
Fityk is portable, open‐source software for nonlinear curve fitting and data analysis. It specializes in fitting a sum of bell‐shaped functions to experimental... 
curve fitting | Pawley refinement | REFINEMENT | CRYSTALLOGRAPHY | POWDER DIFFRACTION | Data analysis | Diffraction | Crystallography | Nonlinear systems | Open source software | Freeware | Fittings | Data processing | Nonlinearity | Portability | Software | Curve fitting | Computer programs
Journal Article
Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 12/2017, Volume 73, Issue a2, pp. C1239 - C1239
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Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2015, Volume 71, Issue a1, pp. s18 - s18
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Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2018, Volume 74, Issue a2, pp. e173 - e173
Journal Article
Journal of Applied Physics, ISSN 0021-8979, 03/2012, Volume 111, Issue 5, pp. 054918 - 054918-8
Interaction between grain boundaries and radiation is studied in 3C-SiC by conducting molecular dynamics cascade simulations on bicrystal samples with... 
ORDER | DEFECTS | PHYSICS, APPLIED | NANOCRYSTALLINE | STATE | UO2 | CASCADES | DAMAGE
Journal Article
Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2015, Volume 71, Issue a1, pp. s195 - s195
Journal Article
Modelling and Simulation in Materials Science and Engineering, ISSN 0965-0393, 10/2010, Volume 18, Issue 7, pp. 075009 - 075009
We have developed a scheme, based on molecular dynamics, that allows finding minimum energy structures of grain boundaries (GBs) with relatively large cell of... 
MOLECULAR-DYNAMICS | ENERGY | PHYSICS, APPLIED | MATERIALS SCIENCE, MULTIDISCIPLINARY | CHEMISTRY | CRYSTALS | SURFACE | SYSTEMS | OPTIMIZATION | SILICON-CARBIDE | MECHANICAL-PROPERTIES | ATOMISTIC SIMULATION | Grain boundaries | Silicon carbide | Molecular structure | Molecular dynamics | Models | Tilt | Atomic structure | Diffusion | Camber
Journal Article
Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2014, Volume 70, Issue a1, pp. C1447 - C1447
"In 2013 MX beamlines at the Diamond synchrotron deployed an automated software pipeline, called DIMPLE, for rapid processing of crystals that contain a known... 
Journal Article
Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2014, Volume 70, Issue a1, pp. C781 - C781
The CCP4 software suite [1] provides a comprehensive set of tools for use in the macromolecule structure solution process by X-ray crystallography.... 
Journal Article
Acta Crystallographica Section A Foundations and Advances, ISSN 2053-2733, 08/2014, Volume 70, Issue a1, pp. C1723 - C1723
CCP4 has been serving the software needs of the protein crystallography community for more than 30 years. In this time the CCP4 Suite of software has been... 
Journal Article
The Journal of Open Source Software, ISSN 2475-9066, 10/2017, Volume 2, Issue 18, p. 350
Journal Article
Journal of Applied Physics, ISSN 0021-8979, 03/2012, Volume 111, Issue 5, p. 054918
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Acta Crystallographica Section A Foundations of Crystallography, ISSN 0108-7673, 08/2013, Volume 69, Issue a1, pp. s299 - s299
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Acta Crystallographica Section A Foundations of Crystallography, ISSN 0108-7673, 08/2013, Volume 69, Issue a1, pp. s295 - s295
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Acta Crystallographica Section A Foundations of Crystallography, ISSN 0108-7673, 08/2013, Volume 69, Issue a1, pp. s300 - s300
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