File:WanF-BaTiO3.png
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| Description |
Maximally Localized Wannier Function for 3p-like band of Titanium in Barium Titanate (BaTiO3). Different planes correspond to different iso-values, the function is real-valued. The pink atom is Titanium, the red ones are Oxygens; the Barium atom is out of the frame in the position correponding to the vertex opposite to the Titanium's one of the cube formed by the Ti-O bonds. |
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| Date | september 2006 | |||||
| Source | PWSCF, WanT and gOpenMol | |||||
| Author | Lorenzo Paulatto (Paulatz) | |||||
| Permission (Reusing this file) |
I, the copyright holder of this work, hereby publish it under the following license:
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| Date/Time | Thumbnail | Dimensions | User | Comment | |
|---|---|---|---|---|---|
| current | 00:44, 10 November 2006 | | 622 × 681 (87 KB) | Paulatz (talk | contribs) | {{Information| |Description = Maximally Localized Wannier Function for 3p-like band of Titanium in Barium Titanate (BaTiO3) |source = [http://www.pwscf.org PWSCF], [http://wannier-transport.org WanT] and [http://www.csc.fi/gopenmol/ gOpenMol] |Date = sept |
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