Recent content by aplahemant

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    Calculating High-Symmetry Point Coordinates in Band Structure Computations

    Continuing with the same question, can anybody demonstrate how to calculate the coordinates of these high symmetry points? Gamma is (0 0 0), X is (0.5 0 0). Now how do you compute for rest of the points? What axis these co-ordinates refer to? and are they 'reduced'? I want to calculate for...
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