𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Some calculations on the hydrogen bond: The system LiH ⃛ Li+

✍ Scribed by G. Shaw

Publisher
John Wiley and Sons
Year
1969
Tongue
English
Weight
292 KB
Volume
3
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Cooperativity between the Dihydrogen Bon
Cooperativity between the Dihydrogen Bond and the N⋅⋅⋅HC Hydrogen Bond in LiH–(HCN)n Complexes
✍ Qing-Zhong Li; Ting Hu; Xiu-Lin An; Bao-An Gong; Jian-Bo Cheng 📂 Article 📅 2008 🏛 John Wiley and Sons 🌐 English ⚖ 192 KB 👁 1 views

## Abstract The cooperativity between the dihydrogen bond and the N⋅⋅⋅HC hydrogen bond in LiH–(HCN)__~n~__ (__n__=2 and 3) complexes is investigated at the MP2 level of theory. The bond lengths, dipole moments, and energies are analyzed. It is demonstrated that synergetic effects are present in the

Perturbation calculations on the variati
Perturbation calculations on the variation of hydrogenbond energies with intermolecular distance
✍ Jeanne G.C.M. Van Duijneveldt-van de Rijdt; Frans B. Van Duijneveldt 📂 Article 📅 1968 🏛 Elsevier Science 🌐 English ⚖ 353 KB

## In previous perturbation calculations on the hydrogen bond [6) the short-range repulsion was serious-Iy underestimated. It is shown that this can be remedied by choosing a more realistic mode1 system and using exact 3-centre integrals.