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exercises:2017_uzh_cmest:band

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exercises:2017_uzh_cmest:band [2017/10/17 11:11]
jglan
exercises:2017_uzh_cmest:band [2017/10/17 11:12] (current)
jglan
Line 119: Line 119:
   * The ''​SPECIAL_POINT''​ keyword is used to specify the start-, mid- and endpoints of the line. Those points usually denote special points in the reciprocal lattice/​unit cell, like the $\Gamma$, $M$ or $K$ point. You can find the definition for these in the appendix section of [[http://​www.sciencedirect.com/​science/​article/​pii/​S0927025610002697|this paper]]. This keyword can also be specified multiple times, making it possible to directly get the band structure for a complete //path//.   * The ''​SPECIAL_POINT''​ keyword is used to specify the start-, mid- and endpoints of the line. Those points usually denote special points in the reciprocal lattice/​unit cell, like the $\Gamma$, $M$ or $K$ point. You can find the definition for these in the appendix section of [[http://​www.sciencedirect.com/​science/​article/​pii/​S0927025610002697|this paper]]. This keyword can also be specified multiple times, making it possible to directly get the band structure for a complete //path//.
  
-Now, when you run this input file you will get in addition the the output file, a file named ''​graphene.bs''​ which will look similar to the following:+Now, when you run this input file you will get in addition the the output file, a file named ''​WO3.bs''​ which will look similar to the following:
  
 <​code>​ <​code>​
exercises/2017_uzh_cmest/band.txt ยท Last modified: 2017/10/17 11:12 by jglan