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Normal vibrations and calculated thermodynamic properties of dimethyldichlorosilane

✍ Scribed by Kazuhiro Shimizu; Hiromu Murata

Publisher
Elsevier Science
Year
1960
Tongue
English
Weight
550 KB
Volume
4
Category
Article
ISSN
0022-2852

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Modified calculations of hydrocarbon the
Modified calculations of hydrocarbon thermodynamic properties
✍ Min Hsien Liu; Cheng Chen πŸ“‚ Article πŸ“… 2006 πŸ› John Wiley and Sons 🌐 English βš– 92 KB

## Abstract A test set of 65 hydrocarbons was examined to elucidate theoretically their thermodynamic properties by performing the density‐functional theory (DFT) and __ab initio__ calculations. All the calculated data were modified using a three‐parameter calibration equation and the least‐squares