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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
Journal of Applied Crystallography, ISSN 1600-5767, 04/2016, Volume 49, Issue 2, pp. 646 - 652
Journal Article
Journal of Structural Biology, ISSN 1047-8477, 04/1999, Volume 125, Issue 2-3, pp. 156 - 165
Journal Article
Journal of Applied Crystallography, ISSN 1600-5767, 04/2012, Volume 45, Issue 2, pp. 329 - 331
The program MossA provides a straightforward approach to the fitting of 57Fe conventional and synchrotron energy‐domain Mössbauer spectra. Sites can be defined... 
nuclear resonance | 57Fe | computer programs | synchrotron radiation | MossA | Mössbauer spectroscopy | CHEMISTRY, MULTIDISCIPLINARY | CRYSTALLOGRAPHY | Nuclear radiation | Particle accelerators | Radiation | Normal distribution | Crystallography | Crystals | Fittings | Splitting | Line shape | Synchrotrons | Amorphous materials | Spectra | Mossbauer effect | Quadrupoles
Journal Article
Surface and Interface Analysis, ISSN 0142-2421, 04/2006, Volume 38, Issue 4, pp. 710 - 714
Program package CONFIT enables a complex processing of 57Fe and 119mSn Mössbauer spectra. The mouse drag‐and‐drop technique is used to set up the background... 
least‐squares procedure | convolution | fitting | fast Fourier transform | Mössbauer spectra | Fast fourier transform | Convolution | Fitting | Least-squares procedure | Mossbauer spectra | least-squares procedure | MATRIX | CHEMISTRY, PHYSICAL
Journal Article
Otology & Neurotology, ISSN 1531-7129, 08/2016, Volume 37, Issue 7, pp. e209 - e216
Journal Article
Journal of Synchrotron Radiation, ISSN 1600-5775, 01/2016, Volume 23, Issue 1, pp. 374 - 380
An analysis program for near‐edge X‐ray absorption fine‐structure (NEXAFS) spectra has been developed and implemented at the soft X‐ray beamline of the... 
NEXAFS | computer programs | absorption spectroscopy | normalization | peak fitting | compositional analysis | Quick AS NEXAFS Tool (QANT) | instant analysis | PHYSICS, APPLIED | CARBON CONTAMINATION | RAY | INSTRUMENTS & INSTRUMENTATION | ABSORPTION FINE-STRUCTURE | ORIENTATION | OPTICS | SPECTRA | POLARIZATION | Particle accelerators | X rays | Fittings | Synchrotrons | Manuals | Spectra | Computing time | Australia | Channels | Standards
Journal Article
1977, Computer-based packages for teaching earth science report, ISBN 0704902826, Volume no. 12., [4], 87
Book
1974, Information circular / United States Department of the Interior, Bureau of Mines, Volume 8649., 50
Book
Journal of Applied Crystallography, ISSN 1600-5767, 02/2018, Volume 51, Issue 1, pp. 219 - 229
Journal Article
Journal of Computational Chemistry, ISSN 0192-8651, 08/2011, Volume 32, Issue 11, pp. 2492 - 2513
A detailed description of the explicitly correlated second-order Moller-Plesset perturbation theory (MP2-F12) method, as implemented in the TURBOMOLE program... 
density fitting | MP2-F12 method | perturbation theory | explicit correlation | Turbomole program | AUXILIARY BASIS-SETS | CRYSTAL-STRUCTURE | AB-INITIO | METHOTREXATE | CHEMISTRY, MULTIDISCIPLINARY | 2ND-ORDER PERTURBATION-THEORY | MOLECULES | WAVE-FUNCTIONS | ENERGIES | EXCHANGE | COUPLED-CLUSTER CALCULATIONS
Journal Article
Journal of Applied Crystallography, ISSN 1600-5767, 02/2019, Volume 52, Issue 1, pp. 201 - 213
Journal Article