✦ LIBER ✦

Electronic structure of binary zirconium compounds: Cluster calculations using different molecular orbital methods

✍ Scribed by A.L. Ivanovsky; V.P. Zhukov; V.A. Gubanov; G.P. Shveikin; J. Weber

Publisher: Elsevier Science
Year: 1980
Tongue: English
Weight: 758 KB
Volume: 41
Category: Article
ISSN: 0022-3697
DOI: 10.1016/0022-3697(80)90138-9

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Electronic structure of binary zirconium

Electronic structure of binary zirconium compounds: cluster calculations using different molecular orbital methods

✍ A.L. Ivanovsky; V.P. Zhukov; V.A. Gubanov; G.P. Shveikin 📂 Article 📅 1980 🏛 Elsevier Science 🌐 English ⚖ 101 KB

Defects and electronic structure of inte

Defects and electronic structure of interfaces in ZnO: Cluster molecular orbital calculations

✍ M.H. Sukkar; K.H. Johnson; H.L. Tuller 📂 Article 📅 1990 🏛 Elsevier Science 🌐 English ⚖ 902 KB

Use of the alternate-molecular-orbit met

Use of the alternate-molecular-orbit method for calculating the electron spectra of alternate systems

✍ N. A. Popov 📂 Article 📅 1968 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 324 KB

A semiempirical linear combination of mo

A semiempirical linear combination of molecular orbitals method for calculating the electronic structure of complex molecules

✍ O. V. Sizova; V. I. Baranovskii; G. B. Perminova; N. V. Ivanova 📂 Article 📅 1984 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 575 KB

Calculation of the electronic stopping c

Calculation of the electronic stopping cross-sections of compounds for low energy protons by using molecular orbitals

✍ Mustafa Çağatay Tufan; Hasan Gümüş; Önder Kabadayi 📂 Article 📅 2007 🏛 Elsevier Science 🌐 English ⚖ 129 KB

The modified Firsov model has been applied to the calculation of the electronic stopping cross-section of compounds for low energy protons by using molecular orbitals. We used the Symmetry Adapted Linear Combination of Atomic Orbitals representation of molecular orbitals, instead of Floating Spheric

Atomic and electronic structures of endo

Atomic and electronic structures of endohedral B36N36 clusters with doping elements studied by molecular orbital calculations

✍ Atsushi Nishiwaki; Takeo Oku; Katsuaki Suganuma 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 450 KB