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Thermodynamic properties of neptunium nitride: a first principles study

✍ Scribed by Shibata, Hiroki; Tsuru, Tomohito; Nishi, Tsuyoshi; Hirata, Masaru; Kaji, Yoshiyuki


Book ID
120657249
Publisher
Japan Science and Technology Information Aggregator, Electronic
Year
2012
Tongue
English
Weight
433 KB
Volume
49
Category
Article
ISSN
0022-3131

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πŸ“œ SIMILAR VOLUMES


Surface properties of titanium nitride:
✍ Chao Wang; Yongbing Dai; Haiyan Gao; Xiaoming Ruan; Jun Wang; Baode Sun πŸ“‚ Article πŸ“… 2010 πŸ› Elsevier Science 🌐 English βš– 467 KB

The low-index surfaces of TiN are calculated using the first-principles method based on density functional theory. It is found that the relaxation effect is mainly localized in the outmost three layers for all surfaces, and the distance reduction of the outmost interlayer for the N-terminated (111)