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wuli8

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[交流] [求助]如何处理wien2k能带数据

以下是数据，如何将这些数据画成二维能带结构图。
谢谢！！

bandindex:          1
0.37211 0.00000 0.74421 0.00000 -58.07272
0.37211 0.37211 0.37211 0.52624 -58.08784
0.00000 0.00000 0.00000 1.17074 -58.13656
0.00000 0.00000 0.37211 1.54285 -58.10445
0.00000 0.00000 0.74421 1.91495 -58.07298
0.00000 0.37211 0.74421 2.28706 -58.07272
  bandindex:          2
0.37211 0.00000 0.74421 0.00000 -34.41748
0.37211 0.37211 0.37211 0.52624 -34.55334
0.00000 0.00000 0.00000 1.17074 -34.20288
0.00000 0.00000 0.37211 1.54285 -34.36504
0.00000 0.00000 0.74421 1.91495 -34.51018
0.00000 0.37211 0.74421 2.28706 -34.41748
  bandindex:          3
0.37211 0.00000 0.74421 0.00000 -34.41748
0.37211 0.37211 0.37211 0.52624 -34.24021
0.00000 0.00000 0.00000 1.17074 -34.20288
0.00000 0.00000 0.37211 1.54285 -34.26242
0.00000 0.00000 0.74421 1.91495 -34.32237
0.00000 0.37211 0.74421 2.28706 -34.41748
  bandindex:          4
0.37211 0.00000 0.74421 0.00000 -34.32987
0.37211 0.37211 0.37211 0.52624 -34.24021
0.00000 0.00000 0.00000 1.17074 -34.20288
0.00000 0.00000 0.37211 1.54285 -34.26242
0.00000 0.00000 0.74421 1.91495 -34.32237
0.00000 0.37211 0.74421 2.28706 -34.32987
  bandindex:          5
0.37211 0.00000 0.74421 0.00000 -10.59889
0.37211 0.37211 0.37211 0.52624 -10.21795
0.00000 0.00000 0.00000 1.17074 -13.28313
0.00000 0.00000 0.37211 1.54285 -11.94604
0.00000 0.00000 0.74421 1.91495 -11.08839
0.00000 0.37211 0.74421 2.28706 -10.59889
  bandindex:          6
0.37211 0.00000 0.74421 0.00000  -4.26864
0.37211 0.37211 0.37211 0.52624  -6.73514
0.00000 0.00000 0.00000 1.17074  -0.64267
0.00000 0.00000 0.37211 1.54285  -4.46484
0.00000 0.00000 0.74421 1.91495  -4.63987
0.00000 0.37211 0.74421 2.28706  -4.26864
  bandindex:          7
0.37211 0.00000 0.74421 0.00000  -4.26864
0.37211 0.37211 0.37211 0.52624  -3.92251
0.00000 0.00000 0.00000 1.17074  -0.64267
0.00000 0.00000 0.37211 1.54285  -1.76040
0.00000 0.00000 0.74421 1.91495  -2.66454
0.00000 0.37211 0.74421 2.28706  -4.26864
  bandindex:          8
0.37211 0.00000 0.74421 0.00000  -3.80904
0.37211 0.37211 0.37211 0.52624  -3.92251
0.00000 0.00000 0.00000 1.17074  -0.64267
0.00000 0.00000 0.37211 1.54285  -1.68830
0.00000 0.00000 0.74421 1.91495  -1.41145
0.00000 0.37211 0.74421 2.28706  -3.80904
  bandindex:          9
0.37211 0.00000 0.74421 0.00000 1.19214
0.37211 0.37211 0.37211 0.52624 1.27901
0.00000 0.00000 0.00000 1.17074 0.23449
0.00000 0.00000 0.37211 1.54285  -1.68830
0.00000 0.00000 0.74421 1.91495  -1.41145
0.00000 0.37211 0.74421 2.28706 1.19214
  bandindex:       10
0.37211 0.00000 0.74421 0.00000 1.19214
0.37211 0.37211 0.37211 0.52624 1.27901
0.00000 0.00000 0.00000 1.17074 0.23449
0.00000 0.00000 0.37211 1.54285 0.65669
0.00000 0.00000 0.74421 1.91495 1.10359
0.00000 0.37211 0.74421 2.28706 1.19214
  bandindex:       11
0.37211 0.00000 0.74421 0.00000 1.80720
0.37211 0.37211 0.37211 0.52624 2.31076
0.00000 0.00000 0.00000 1.17074 0.24471
0.00000 0.00000 0.37211 1.54285 2.06396
0.00000 0.00000 0.74421 1.91495 1.80999
0.00000 0.37211 0.74421 2.28706 1.80720
  bandindex:       12
0.37211 0.00000 0.74421 0.00000 3.11136
0.37211 0.37211 0.37211 0.52624 6.06276
0.00000 0.00000 0.00000 1.17074 0.24471
0.00000 0.00000 0.37211 1.54285 2.06396
0.00000 0.00000 0.74421 1.91495 1.80999
0.00000 0.37211 0.74421 2.28706 3.11136
  bandindex:       13
0.37211 0.00000 0.74421 0.00000 3.31336
0.37211 0.37211 0.37211 0.52624 6.06276
0.00000 0.00000 0.00000 1.17074 0.24471
0.00000 0.00000 0.37211 1.54285 4.01409
0.00000 0.00000 0.74421 1.91495 3.71323
0.00000 0.37211 0.74421 2.28706 3.31336
  bandindex:       14
0.37211 0.00000 0.74421 0.00000  11.81165
0.37211 0.37211 0.37211 0.52624 6.39061
0.00000 0.00000 0.00000 1.17074 7.85426
0.00000 0.00000 0.37211 1.54285  10.59733
0.00000 0.00000 0.74421 1.91495 9.13182
0.00000 0.37211 0.74421 2.28706  11.81165
  bandindex:       15
0.37211 0.00000 0.74421 0.00000  11.81165
0.37211 0.37211 0.37211 0.52624  12.68114
0.00000 0.00000 0.00000 1.17074  12.37848
0.00000 0.00000 0.37211 1.54285  12.59786
0.00000 0.00000 0.74421 1.91495  12.75872
0.00000 0.37211 0.74421 2.28706  11.81165

[ Last edited by wuli8 on 2009-6-21 at 22:48 ]

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