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Hydrogen-bonding contributions to the lattice energy of salts for second harmonic generation

✍ Scribed by Christer B. Aakeröy; Kenneth R. Seddon; Maurice Leslie

Publisher
Springer
Year
1992
Tongue
English
Weight
324 KB
Volume
3
Category
Article
ISSN
1040-0400

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📜 SIMILAR VOLUMES

Computations of intermolecular interacti
Computations of intermolecular interactions: Expansion of a charge-transfer energy contribution in the framework of an additive procedure. Applications to hydrogen-bonded systems
✍ N. Gresh; P. Claverie; A. Pullman 📂 Article 📅 1982 🏛 John Wiley and Sons 🌐 English ⚖ 874 KB

## Abstract A procedure is given to derive an explicit charge‐transfer contribution from the Murrell–Randic–Williams formula, and to implement it in the framework of an additive procedure for the computation of intermolecular interaction energies, as a sum of electrostatic, repulsion, polarization,