I'm sure it's in the list because I changed to 25 the k-points to
interpolate. Here it's the mbp output related..... Initializing dielectric function... 27 k-points: (0,0.5,0) (0,0.480769,0) (0,0.461538,0) (0,0.442308,0) (0,0.423077,0) (0,0.403846,0) (0,0.384615,0) (0,0.365385,0) (0,0.346154,0) (0,0.326923,0) (0,0.307692,0) (0,0.288462,0) (0,0.269231,0) (0,0.25,0) (0,0.230769,0) (0,0.211538,0) (0,0.192308,0) (0,0.173077,0) (0,0.153846,0) (0,0.134615,0) (0,0.115385,0) (0,0.0961538,0) (0,0.0769231,0) (0,0.0576923,0) (0,0.0384615,0) (0,0.0192308,0) (0,0,0) Any other suggestion? Thank you Emiliano Steven G. Johnson wrote:
On Wed, 8 Nov 2006, Emiliano Di Gennaro wrote:(run-tm (output-at-kpoint (vector3 0 .25 0) fix-efield-phase output-efield-z)) being sure that ( 0 0.25 0) was in the k-points list. What it's wrong?Probably, (0 0.25 0) is not in the k-points list? It's certainly not in the default k-points list for the tri-rods.ctl example file, whose default k-points are:(0,0,0) (0,0.1,0) (0,0.2,0) (0,0.3,0) (0,0.4,0) (0,0.5,0) (-0.0666667,0.466667,0) (-0.133333,0.433333,0) (-0.2,0.4,0) (-0.266667,0.366667,0) (-0.333333,0.333333,0) (-0.266667,0.266667,0) (-0.2,0.2,0) (-0.133333,0.133333,0) (-0.0666667,0.0666667,0) (0,0,0) Steven _______________________________________________ mpb-discuss mailing list [email protected] http://ab-initio.mit.edu/cgi-bin/mailman/listinfo/mpb-discuss
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