𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Some problems of surface quantum chemistry

✍ Scribed by J. Koutecký

Book ID
104580198
Publisher
John Wiley and Sons
Year
2009
Tongue
English
Weight
68 KB
Volume
18
Category
Article
ISSN
0020-7608

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Some recent mathematical contributions t
Some recent mathematical contributions to quantum chemistry
✍ Eric Cances; Mireille Defranceschi; Claude Le Bris 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 125 KB 👁 2 views

The purpose of this short article is twofold. First, we would like to take the opportunity of this special volume to deliver some modest reflexion on what we believe to be the real plus-value of the mathematical analysis of the models of quantum chemistry. As a secondary purpose, we wish to draw the

The generalized eigenvalue problem in qu
The generalized eigenvalue problem in quantum chemistry
✍ Brian Ford; George Hall 📂 Article 📅 1974 🏛 Elsevier Science 🌐 English ⚖ 689 KB

The matrix form of the molecular orbital equations is that of a generalized eigenvalue eq~iation, when the basis functions are non-orthogonal. Five algorithms for the reduction of this equation to standardẽigenvalue form are analysed and compared. The behaviour of the algorithms as the overlap matri