✦ LIBER ✦

Crystal Structure of KAlH4 from First Principle Calculations.

✍ Scribed by P. Vajeeston; P. Ravindran; A. Kjekshus; H. Fjellvaag

Publisher: John Wiley and Sons
Year: 2004
Weight: 56 KB
Volume: 35
Category: Article
ISSN: 0931-7597
DOI: 10.1002/chin.200411002

No coin nor oath required. For personal study only.

✦ Synopsis

Abstract

For Abstract see ChemInform Abstract in Full Text.

📜 SIMILAR VOLUMES

Calculations of protein circular dichroi

Calculations of protein circular dichroism from first principles

✍ David M. Rogers; Jonathan D. Hirst 📂 Article 📅 2004 🏛 John Wiley and Sons 🌐 English ⚖ 372 KB 👁 1 views

Structure and Bonding in BAlH5 (B: Be, C

Structure and Bonding in BAlH5 (B: Be, Ca, Sr) from First-Principle Calculations.

✍ A. Klaveness; P. Vajeeston; P. Ravindran; H. Fjellvaag; A. Kjekshus 📂 Article 📅 2007 🏛 John Wiley and Sons ⚖ 11 KB 👁 1 views

Structure-sensitivity of CH3 dissociatio

Structure-sensitivity of CH3 dissociation on Ni(100)from first-principles calculations

✍ Yi-An Zhu; Xing-Gui Zhou; De Chen; Wei-Kang Yuan 📂 Article 📅 2009 🏛 Wiley (John Wiley & Sons) 🌐 English ⚖ 299 KB 👁 1 views

ChemInform Abstract: Electronic Band Str

ChemInform Abstract: Electronic Band Structure of CaUO4 from First Principles

✍ S. F. Matar; G. Demazeau 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 12 KB 👁 2 views

## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 100 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a “Full Text” option. The original article is trackable v

First-Principles Energy Band Calculation

First-Principles Energy Band Calculation for SrAl2O4 with Monoclinic Structure.

✍ Shigenori Matsushima; Hiroyuki Nakamura; Masao Arai; Chao-Nan Xu 📂 Article 📅 2010 🏛 John Wiley and Sons ⚖ 26 KB 👁 1 views

Structural Stability of Alkali Boron Tet

Structural Stability of Alkali Boron Tetrahydrides ABH4 (A: Li, Na, K, Rb, Cs) from First Principle Calculation.

✍ P. Vajeeston; P. Ravindran; A. Kjekshus; H. Fjellvag 📂 Article 📅 2005 🏛 John Wiley and Sons ⚖ 8 KB 👁 1 views