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DESCRIPTION
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Package: rgl.cry
Title: 'cry' and 'rgl' — Applications in Crystallography
Version: 0.1.1
Authors@R:
person("Toshihide", "Saitou", , "[email protected]", role = c("aut", "cre", "cph"))
Description: Visualizing crystal structures and selected area electron diffraction (SAED) patterns. It provides functions cry_demo() and dp_demo() to load a file in 'CIF' (Crystallographic Information Framework) formats and display crystal structures and electron diffraction patterns. The function dp_demo() also performs simple simulation of powder X-ray diffraction (PXRD) patterns, and the results can be saved to a file in the working directory. The package has been tested on several platforms, including Linux on 'Crostini' with a Core™ m3-8100Y Chromebook, I found that even on this low-powered platform, the performance was acceptable.
T. Hanashima (2001) <https://www2.kek.jp/imss/pf/tools/sasaki/sinram/sinram.html>
Todd Helmenstine (2019) <https://sciencenotes.org/molecule-atom-colors-cpk-colors/>
Wikipedia contributors (2023) <https://en.wikipedia.org/w/index.php?title=Atomic_radius&oldid=1179864711>.
License: GPL (>= 2)
Encoding: UTF-8
Roxygen: list(markdown = TRUE)
RoxygenNote: 7.3.1
Imports:
cry,
pracma,
rgl,
pryr,
utils
Collate:
'zzz.R'
'cry_demo.R'
'dp_demo.R'
'getCIF.R'
'align.R'
'select.R'
'rgl.cry-package.R'
Suggests:
knitr,
rmarkdown,
spelling,
testthat (>= 3.0.0)
Config/testthat/edition: 3
URL: https://github.com/SaitouToshihide/rgl.cry/, https://saitoutoshihide.github.io/rgl.cry/
Language: en-US