1887
banner image
No data available.
Please log in to see this content.
You have no subscription access to this content.
No metrics data to plot.
The attempt to load metrics for this article has failed.
The attempt to plot a graph for these metrics has failed.
Prediction of graphitelike from first-principles calculations
Rent:
Rent this article for
USD
10.1063/1.3078800
/content/aip/journal/jap/105/4/10.1063/1.3078800
http://aip.metastore.ingenta.com/content/aip/journal/jap/105/4/10.1063/1.3078800

Figures

Image of FIG. 1.
FIG. 1.

Relaxed five possible hexagonal structures constructed from -graphite structure.

Image of FIG. 2.
FIG. 2.

(a) The calculated formation energy vs hydrostatic pressure of and (b) previously predicted , (c) and the relative volume vs hydrostatic pressure of graphite, BN, and .

Image of FIG. 3.
FIG. 3.

(a) Band structure and (b) enlarged band structure near point and point of .

Tables

Generic image for table
Table I.

The relaxed structural parameters, densities , total energy , and formation energy of five graphitelike , -graphite, and .

Loading

Article metrics loading...

/content/aip/journal/jap/105/4/10.1063/1.3078800
2009-02-19
2014-04-16
Loading

Full text loading...

This is a required field
Please enter a valid email address
752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Prediction of graphitelike BC4N from first-principles calculations
http://aip.metastore.ingenta.com/content/aip/journal/jap/105/4/10.1063/1.3078800
10.1063/1.3078800
SEARCH_EXPAND_ITEM