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SINDO1 study of sulphur isomers and sulphur fluorine compounds

✍ Scribed by Karl Jug; Rüdiger Iffert


Book ID
113256898
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
787 KB
Volume
186
Category
Article
ISSN
0166-1280

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Application of SINDO1 to sulphur compoun
✍ Karl Jug; Rüdiger Iffert 📂 Article 📅 1987 🏛 John Wiley and Sons 🌐 English ⚖ 674 KB

SINDOl calculations are presented for ground state geometries, heats of formation, ionization potentials and dipole moments. These calculations are based on a new parametrization of SINDOl for second-row elements which features inclusion of 3d orbitals and zero point energies. The comparison shows a