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| | Brillouin Zone: Generation of Band Structures (Site not responding. Last check: 2007-11-06) |
 | | Of all the unit cells, this one is the only one for which the entire Fock matrix is not present; instead only the lower-half triangle is available. |
 | | The Fock matrix representing the interaction of the CUC with the next unit cell, (0,0,1), or (0,0,2) if BCC is specified, is then extracted, as are all the small Fock matrices. |
 | | As phrases of the type "The Fock matrix representing the interaction of the CUC with unit cell (i,j,k)" are cumbersome, from here on, the term "unit cell (i,j,k)" should be understood as having the same meaning. |
| www.cachesoftware.com /mopac/Mopac2002manual/node558.html (838 words) |
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