✦ LIBER ✦

Ab initio calculation of Ag monolayer adhesion on BaTiO3 (100) surfaces

✍ Scribed by Jie Cui; Jian-Min Zhang; Ke-Wei Xu; Vincent Ji; Zhen-Yong Man

Publisher: Elsevier Science
Year: 2008
Tongue: English
Weight: 547 KB
Volume: 202
Category: Article
ISSN: 0257-8972
DOI: 10.1016/j.surfcoat.2007.11.035

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio calculation of the SiC (100) s

Ab initio calculation of the SiC (100) surfaces phonon dispersion

✍ J.S. Soares; H.W. Leite Alves 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 316 KB

In this work, we have calculated ab initio the vibrational modes and the phonon frequencies for the SiC (100) surfaces. Our results are in good agreement with the available experimental data whenever this comparison is possible: in fact, most of our obtained results are predictions. For the accepted

Vibrational frequencies of halogens adso

Vibrational frequencies of halogens adsorbed on Ag (100) based on ab initio cluster model calculations

✍ F. Illas; J. Rubio; J.M. Ricart; J.A. Garrido 📂 Article 📅 1986 🏛 Elsevier Science ⚖ 421 KB

Ab initio calculation of the structural

Ab initio calculation of the structural and electronic properties of the SiC (100) Surfaces

✍ J.S. Soares; H.W. Leite Alves 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 238 KB

Ab initio calculations of an M center on

Ab initio calculations of an M center on the AgBr(100) surface. Formation, electronic structure and spectrum of a primary Ag2 cluster

✍ K.B. Shelimov; A.A. Safonov; A.A. Bagatur'yants 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 408 KB

The electronic and atomic structure of S

The electronic and atomic structure of SrTiO3, BaTiO3, and PbTiO3(0 0 1) surfaces: Ab initio DFT/HF hybrid calculations

✍ S. Piskunov; E.A. Kotomin; E. Heifets 📂 Article 📅 2005 🏛 Elsevier Science 🌐 English ⚖ 273 KB

Structural properties of Na adsorbed on

Structural properties of Na adsorbed on a Ge(100)2 × 1 surface: all electron, ab initio, density functional, cluster calculations

✍ L. Spiess; E. Wimmer; P. Soukiassian 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 386 KB