✦ LIBER ✦

Extracting convergent surface energies from slab calculations

✍ Scribed by Fiorentini, Vincenzo; Methfessel, M

Book ID: 121368774
Publisher: Institute of Physics
Year: 1996
Tongue: English
Weight: 74 KB
Volume: 8
Category: Article
ISSN: 0953-8984
DOI: 10.1088/0953-8984/8/36/005

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Extracting complex resonance energies fr

Extracting complex resonance energies from real calculations

✍ Durand, Ph; Paidarová, I 📂 Article 📅 2013 🏛 Institute of Physics 🌐 English ⚖ 264 KB

Nonconvergence of surface energies obtai

Nonconvergence of surface energies obtained from thin-film calculations

✍ Boettger, J. C. 📂 Article 📅 1994 🏛 The American Physical Society 🌐 English ⚖ 136 KB

Potential energy surfaces for RhCO from

Potential energy surfaces for RhCO from DFT calculations

✍ W. Biemolt; A. P. J. Jansen 📂 Article 📅 1994 🏛 John Wiley and Sons 🌐 English ⚖ 999 KB

We present potential energy surfaces for Rh-CO obtained from density functional theory for two electronic states of Rh-CO. We have performed local spin-density calculations including relativistic as well as gradient corrections. The construction of a reasonably accurate atom-atom potential for Rh-CO

Extracting energy of surface wave from p

Extracting energy of surface wave from plasmatic waveguide

✍ G. I. Zaginailov; A. N. Kondratenko; V. M. Kuklin 📂 Article 📅 1984 🏛 Springer US 🌐 English ⚖ 363 KB

Calculating the surface energy of glasse

Calculating the surface energy of glasses from the microhardness

✍ A. S. Makhavetskii 📂 Article 📅 1965 🏛 Springer US 🌐 English ⚖ 119 KB

Calculation of Ionic Crystal Surface Ene

Calculation of Ionic Crystal Surface Energies from Thermodynamic Data

✍ A. O. Walton 📂 Article 📅 1965 🏛 John Wiley and Sons 🌐 English ⚖ 272 KB