✦ LIBER ✦

Ab initio study of diamond C(100) surfaces

✍ Scribed by Yang, Sang H.; Drabold, David A.; Adams, James B.

Book ID: 125523019
Publisher: The American Physical Society
Year: 1993
Tongue: English
Weight: 181 KB
Volume: 48
Category: Article
ISSN: 1098-0121
DOI: 10.1103/PhysRevB.48.5261

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

The (100), (111) and (110) surfaces of d

The (100), (111) and (110) surfaces of diamond: an ab initio B3LYP study

✍ De La Pierre, Marco; Bruno, Marco; Manfredotti, Chiara; Nestola, Fabrizio; Prenc 📂 Article 📅 2013 🏛 Taylor and Francis Group 🌐 English ⚖ 314 KB

Ab initio studies of H chemisorption on

Ab initio studies of H chemisorption on C(100) surface

✍ Z. Jing; J.L. Whitten 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 611 KB

Hydrogen chemisorption on a boron-termin

Hydrogen chemisorption on a boron-terminated diamond (100) surface: an ab initio study

✍ X.M. Zheng; J. Zeng 📂 Article 📅 1998 🏛 Elsevier Science 🌐 English ⚖ 228 KB

Ab initio studies of Si(100) surface rec

Ab initio studies of Si(100) surface reconstruction

✍ Ze Jing; Jerry L. Whitten 📂 Article 📅 1992 🏛 Elsevier Science 🌐 English ⚖ 687 KB

Diamond (111) and (100) surface: ab init

Diamond (111) and (100) surface: ab initio study of the atomic and electronic structure

✍ A. Scholze; W.G. Schmidt; P. Käckell; F. Bechstedt 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 407 KB

Within the framework of density-functional theory in local-density approximation (DFT-LDA) we perform first-principles calculations for the atomic and electronic structure of diamond surfaces. The electron-ion interaction is described by a soft non-local carbon pseudopotential. For the C(100) surfac

Defective pyrite (100) surface: An ab in

Defective pyrite (100) surface: An ab initio study

✍ Stirling, András; Bernasconi, Marco; Parrinello, Michele 📂 Article 📅 2007 🏛 The American Physical Society 🌐 English ⚖ 583 KB