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celine蔡

新虫 (小有名气)

应助: 1 (幼儿园)
金币: 144.1
散金: 5
红花: 2
帖子: 97
在线: 40.1小时
虫号: 1894278
注册: 2012-07-15
专业: 理论和计算化学

[求助] origin画分子轨道能量图求助

怎么用origin画gaussian优化后的分子轨道能量图求具体细节
Alpha  occ. eigenvalues -- -131.92737-131.92731 -90.95492 -90.95483 -20.29972
Alpha  occ. eigenvalues --  -20.29809 -20.26183 -20.25659 -20.20008 -20.19667
Alpha  occ. eigenvalues --  -20.07870 -20.07865 -20.07849 -20.07845 -20.07457
Alpha  occ. eigenvalues --  -20.07447 -15.40146 -15.39993 -14.14825 -14.14819
Alpha  occ. eigenvalues --  -11.25291 -11.25285 -11.25268 -11.25267 -11.25261
Alpha  occ. eigenvalues --  -11.25261 -11.16973 -11.16756 -11.12700 -11.12536
Alpha  occ. eigenvalues --  -11.11519 -11.11302 -11.11246 -11.10220 -11.10216
Alpha  occ. eigenvalues --  -11.10205 -11.08924 -11.08904 -11.06482 -11.06080
Alpha  occ. eigenvalues --  -11.06054 -11.06003 -11.05826 -11.05786 -11.05754
Alpha  occ. eigenvalues --  -11.05721 -11.05700 -11.05591 -11.05565 -11.05399
Alpha  occ. eigenvalues --  -11.05365 -11.05245 -11.04996 -11.04922 -11.04911
Alpha  occ. eigenvalues --  -11.04894 -11.04891 -11.04831 -11.04675 -11.04673
Alpha  occ. eigenvalues --  -11.04495 -11.04445 -11.04326 -11.04251 -11.03627
Alpha  occ. eigenvalues --  -11.03533 -11.01754 -11.01710  -8.82869  -8.82860
Alpha  occ. eigenvalues -- -6.46251  -6.46243  -6.46027  -6.46018  -6.46013
Alpha  occ. eigenvalues -- -6.46004  -1.66428  -1.66421  -1.37114  -1.36174
Alpha  occ. eigenvalues -- -1.28639  -1.27320  -1.27151  -1.26922  -1.24501
Alpha  occ. eigenvalues -- -1.24444  -1.18844  -1.18835  -1.12743  -1.12335
Alpha  occ. eigenvalues -- -1.11226  -1.11050  -1.10374  -1.07163  -1.07135
Alpha  occ. eigenvalues -- -1.06971  -1.06967  -1.06802  -1.06530  -1.01619
Alpha  occ. eigenvalues -- -1.01344  -1.00792  -0.99505  -0.98106  -0.97653
Alpha  occ. eigenvalues -- -0.97465  -0.97420  -0.95550  -0.94734  -0.91781
Alpha  occ. eigenvalues -- -0.90792  -0.90247  -0.90152  -0.88207  -0.88090
Alpha  occ. eigenvalues -- -0.87844  -0.87842  -0.87837  -0.87835  -0.85127
Alpha  occ. eigenvalues -- -0.83868  -0.82696  -0.81982  -0.80089  -0.79972
Alpha  occ. eigenvalues -- -0.79313  -0.78964  -0.78516  -0.77445  -0.75039
Alpha  occ. eigenvalues -- -0.73836  -0.72565  -0.72359  -0.72237  -0.71667
Alpha  occ. eigenvalues -- -0.71310  -0.68427  -0.67259  -0.65725  -0.65014
Alpha  occ. eigenvalues -- -0.64711  -0.64068  -0.63036  -0.62583  -0.61802
Alpha  occ. eigenvalues -- -0.61013  -0.59899  -0.59367  -0.58950  -0.58628
Alpha  occ. eigenvalues -- -0.58535  -0.58268  -0.57729  -0.57589  -0.57191
Alpha  occ. eigenvalues -- -0.56739  -0.56519  -0.56446  -0.56317  -0.56191
Alpha  occ. eigenvalues -- -0.55744  -0.55549  -0.55066  -0.54646  -0.53962
Alpha  occ. eigenvalues -- -0.53797  -0.53767  -0.53304  -0.53005  -0.52848
Alpha  occ. eigenvalues -- -0.52491  -0.51994  -0.51754  -0.51373  -0.51071
Alpha  occ. eigenvalues -- -0.50510  -0.49987  -0.49385  -0.49118  -0.48965
Alpha  occ. eigenvalues -- -0.48522  -0.48416  -0.46789  -0.46315  -0.46312
Alpha  occ. eigenvalues -- -0.46148  -0.46043  -0.45784  -0.45558  -0.45495
Alpha  occ. eigenvalues -- -0.45256  -0.44893  -0.43837  -0.43288  -0.43130
Alpha  occ. eigenvalues -- -0.43000  -0.42885  -0.41884  -0.41688  -0.40611
Alpha  occ. eigenvalues -- -0.40347  -0.39914  -0.39888  -0.39712  -0.35820
Alpha  occ. eigenvalues -- -0.35503  -0.34066  -0.34022  -0.33444  -0.33355
Alpha  occ. eigenvalues -- -0.30572  -0.30458  -0.30216  -0.30128  -0.29778
Alpha  occ. eigenvalues -- -0.28996  -0.28544  -0.28263  -0.28258  -0.27621
Alpha  occ. eigenvalues -- -0.27526  -0.27408  -0.27405  -0.26894  -0.26889
Alpha  occ. eigenvalues -- -0.26542  -0.25543  -0.24827  -0.23921  -0.23916
Alpha  occ. eigenvalues -- -0.23274  -0.22875  -0.14322
Alpha virt. eigenvalues -- 0.12174 0.19950 0.19956 0.20875 0.21125
Alpha virt. eigenvalues -- 0.23594 0.24623 0.24658 0.24834 0.25035
Alpha virt. eigenvalues -- 0.25777 0.29097 0.30338 0.33916 0.34771
Alpha virt. eigenvalues -- 0.37741 0.37764 0.38110 0.40203 0.40221
Alpha virt. eigenvalues -- 0.40309 0.40372 0.45029 0.46034 0.46564
Alpha virt. eigenvalues -- 0.47574 0.47638 0.48264 0.49401 0.50350
Alpha virt. eigenvalues -- 0.50721 0.51400 0.51440 0.51778 0.51790
Alpha virt. eigenvalues -- 0.52390 0.52595 0.53342 0.53377 0.54728
Alpha virt. eigenvalues -- 0.55118 0.57193 0.57764 0.57883 0.58438
Alpha virt. eigenvalues -- 0.60276 0.60534 0.61341 0.61385 0.62033
Alpha virt. eigenvalues -- 0.62282 0.62459 0.62817 0.63075 0.63961
Alpha virt. eigenvalues -- 0.64288 0.65004 0.65821 0.66039 0.66490
Alpha virt. eigenvalues -- 0.66590 0.66716 0.66884 0.67617 0.67802
Alpha virt. eigenvalues -- 0.68092 0.68751 0.69551 0.69721 0.70068
Alpha virt. eigenvalues -- 0.70635 0.70820 0.71486 0.71664 0.71706
Alpha virt. eigenvalues -- 0.72582 0.72829 0.73135 0.73426 0.73635
Alpha virt. eigenvalues -- 0.75026 0.75255 0.75544 0.75783 0.76137
Alpha virt. eigenvalues -- 0.77384 0.77482 0.77875 0.78078 0.78534
Alpha virt. eigenvalues -- 0.80898 0.82029 0.82660 0.82726 0.83772
Alpha virt. eigenvalues -- 0.83900 0.84390 0.86383 0.86559 0.86980
Alpha virt. eigenvalues -- 0.87436 0.88231 0.89059 0.89578 0.89861
Alpha virt. eigenvalues -- 0.90284 0.90793 0.91871 0.92285 0.94083
Alpha virt. eigenvalues -- 0.95870 0.99267 1.00043 1.00382 1.06263
Alpha virt. eigenvalues -- 1.06478 1.08813 1.08922 1.10042 1.11279
Alpha virt. eigenvalues -- 1.13054 1.13327 1.13339 1.13696 1.25456

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