Pitzer Inertias
MATLAB codes to calculate effective Pitzer inertias for internal rotation
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This is a complete set of MATLAB codes for calculating effective Pitzer inertias for large amplitude torsions. Specific examples included in the zip file were taken from the publication by Bryan M. Wong, Ryan L. Thom, and Robert W. Field in The Journal of Physical Chemistry A 110, 7406 - 7413 (2006). The values outputted by I_Pitzer correspond to the Pitzer inertias depicted in Figure 1 (a-f) of the aforementioned publication.
Cite As
Bryan Wong (2026). Pitzer Inertias (https://www.mathworks.com/matlabcentral/fileexchange/16116-pitzer-inertias), MATLAB Central File Exchange. Retrieved .
General Information
- Version 1.0.0.0 (259 KB)
-
No License
MATLAB Release Compatibility
- Compatible with any release
Platform Compatibility
- Windows
- macOS
- Linux
| Version | Published | Release Notes | Action |
|---|---|---|---|
| 1.0.0.0 |
