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Computer-aided calculation of the ingot temperature in a pressure casting mold

✍ Scribed by A. V. Éitutis

Publisher
Springer US
Year
1971
Tongue
English
Weight
65 KB
Volume
20
Category
Article
ISSN
1573-871X

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The cis/trans isomerization of Cu(II)–bi
The cis/trans isomerization of Cu(II)–bis-(glycinato) complex in solution: a computer aided multifrequency EPR and DFT/PCM calculation study
✍ M. Pezzato; G. Della Lunga; M. C. Baratto; A. Sinicropi; R. Pogni; R. Basosi 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 309 KB

## Abstract In this paper the Cu(II)–bis‐(glycinato) complex has been analysed in solution by applying a combined approach of multifrequency EPR and DFT/PCM calculations. The accuracy in the determination of magnetic parameters has been reached by the use of a unique simulation program (COSMOS) for