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.
Impact of hydrogen and oxygen defects on the lattice parameter of chemical vapor deposited zinc sulfide
Rent:
Rent this article for
USD
10.1063/1.4774078
/content/aip/journal/jap/113/2/10.1063/1.4774078
http://aip.metastore.ingenta.com/content/aip/journal/jap/113/2/10.1063/1.4774078

Figures

Image of FIG. 1.
FIG. 1.

Computed equilibrium structures of cubic ZnS and its point defects: (a) pure ZnS, (b) Zn-vacancy with two H atoms, (c) S-vacancy with two H atoms, (d) Zn on S-site, (e) ZnH2 on S-site, (f)ZnH4 on S-site, (g) interstitial H, (h) peroxy defect (O2) on S-site, (i) interstitial O (SO dumbbell), (j) interstitial S (S2 dumbbell), (k) dihydroxy defect (OH)2, and (l) water defect on S-site. Interatomic distances are given in Å.

Tables

Generic image for table
Table I.

Calculated lattice parameter values taken from published expressions, assuming [O] is 0.22–0.60 at. % as measured by IGA. Details on the fabrication differences of these ZnS samples have been previously discussed. 18,19

Generic image for table
Table II.

Energy of formation of point defects and their influence on the equilibrium lattice parameter of cubic ZnS. All calculations were performed on the DFT-GGA level of theory for a supercell with 32 sites on each sub-lattice. Table is ranked according to relative effect on the lattice parameter.

Loading

Article metrics loading...

/content/aip/journal/jap/113/2/10.1063/1.4774078
2013-01-09
2014-04-24
Loading

Full text loading...

This is a required field
Please enter a valid email address
752b84549af89a08dbdd7fdb8b9568b5 journal.articlezxybnytfddd
Scitation: Impact of hydrogen and oxygen defects on the lattice parameter of chemical vapor deposited zinc sulfide
http://aip.metastore.ingenta.com/content/aip/journal/jap/113/2/10.1063/1.4774078
10.1063/1.4774078
SEARCH_EXPAND_ITEM