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Baseline correction, normalization and linear combination fitting (LCF) of X-ray absorption near edge structure (XANES) spectra. The package includes data loading of .xmu files exported from 'ATHENA' (Ravel and Newville, 2005) <doi:10.1107/S0909049505012719>. Loaded spectra can be background corrected and all standards can be fitted at once. Two linear combination fitting functions can be used: (1) fit_athena(): Simply fitting combinations of standards as in ATHENA, (2) fit_float(): Fitting all standards with changing baseline correction and edge-step normalization parameters.
| Version: | 1.7.0 |
| Depends: | R (≥ 3.2.1) |
| Imports: | quadprog |
| Published: | 2017-11-22 |
| Author: | Florian Werner [aut, cre] |
| Maintainer: | Florian Werner <florian.werner at wzw.tum.de> |
| License: | GPL-3 |
| NeedsCompilation: | no |
| CRAN checks: | LCF results |
| Reference manual: | LCF.pdf |
| Package source: | LCF_1.7.0.tar.gz |
| Windows binaries: | r-devel: LCF_1.7.0.zip, r-release: LCF_1.7.0.zip, r-oldrel: LCF_1.7.0.zip |
| macOS binaries: | r-release (arm64): LCF_1.7.0.tgz, r-oldrel (arm64): LCF_1.7.0.tgz, r-release (x86_64): LCF_1.7.0.tgz, r-oldrel (x86_64): LCF_1.7.0.tgz |
| Old sources: | LCF archive |
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These binaries (installable software) and packages are in development.
They may not be fully stable and should be used with caution. We make no claims about them.