𝔖 Bobbio Scriptorium
✦   LIBER   ✦

crystal studied by the self-consistent-charge extended Hückel method

✍ Scribed by Kitamura, Michihide; Sugiura, Chikara; Muramatsu, Shinji

Book ID
120976224
Publisher
The American Physical Society
Year
1989
Tongue
English
Weight
434 KB
Volume
39
Category
Article
ISSN
1098-0121

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Self-Consistent methods in Hückel and ex
Self-Consistent methods in Hückel and extended Hückel theories
✍ A. K. Mukhopadhyay; N. G. Mukherjee 📂 Article 📅 1981 🏛 John Wiley and Sons 🌐 English ⚖ 214 KB

## Abstract A self‐consistent procedure for the Hückel theory, first indicated by Harris [J. Chem. Phys. **48**, 4027 (1968)] has been fully developed. To avoid time consuming repeated orthogonal‐nonorthogonal transformations and diagonalization of large matrices, a steepest descent technique has b