## Abstract A combinatorial scan of a total of 810 full Heusler alloys is performed on the basis of firstβprinciples (GGA) totalβenergy calculations using pseudopotentials and plane waves to predict their lattice parameters and magnetic moments. About 60% of the investigated intermetallics turn out
First principles calculation of optical properties of BaWO4: A study by full potential method
β Scribed by Mohit Tyagi; S.G. Singh; A.K. Chauhan; S.C. Gadkari
- Publisher
- Elsevier Science
- Year
- 2010
- Tongue
- English
- Weight
- 991 KB
- Volume
- 405
- Category
- Article
- ISSN
- 0921-4526
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## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract of an article which was published elsewhere, please select a βFull Textβ option. The original article is trackable v
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