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abc_249

银虫 (初入文坛)

应助: 0 (幼儿园)
金币: 221
帖子: 8
在线: 19.2小时
虫号: 2030951
注册: 2012-09-26
专业: 原子和分子物理

[求助] 怎么消频和频率下的坐标有什么用

Frequencies (cm-1) and normal modes
      1: -8.2 2: 0.0 3: 0.0 4: 0.0 5: 0.0 6: 0.0 7: 0.0 8: 31.3 9: 89.1

Mg x    0.2205    -0.0343    0.0665    0.1512    0.4215    0.0549    -0.0177    0.2100    -0.1247
y    -0.2199    -0.2734    0.1589    0.0926    0.1146    -0.1974    0.2157    0.0539    -0.3232
z    -0.2959    -0.1975    -0.2451    -0.2890    0.0235    -0.2545    0.0795    -0.1420    -0.1622
Mg x    0.2957    -0.0224    0.0764    0.1472    0.4229    0.0541    -0.0211    0.0808    -0.1706
y    0.0528    -0.1340    0.3012    -0.2459    -0.1026    -0.1685    -0.0167    0.1299    0.2807
z    0.2751    0.1833    0.0527    -0.1840    0.2544    -0.3079    0.1233    0.1577    0.0794
Mg x    -0.2324    0.1237    0.2192    -0.1733    0.2117    0.0829    -0.2558    -0.2053    0.1438
y    0.2228    -0.1345    0.3044    -0.2564    -0.1025    -0.1694    -0.0126    -0.0383    0.3502
z    -0.2823    0.2944    -0.0286    0.1740    0.1260    -0.2434    -0.2241    -0.1513    -0.1419
Mg x    -0.2796    0.1252    0.2199    -0.1661    0.2184    0.0817    -0.2507    -0.0958    0.1709
y    -0.0865    -0.2773    0.1656    0.0680    0.1186    -0.2005    0.2314    -0.1393    -0.2829
z    0.2773    -0.0849    -0.3253    0.0696    -0.1041    -0.1902    -0.2679    0.1512    0.0788
Mg x    -0.1065    -0.2607    -0.0975    -0.1036    0.1170    0.1148    -0.1872    0.2855    0.0147
y    -0.0528    -0.0156    0.2581    -0.0114    -0.2569    -0.1076    -0.3576    0.0272    -0.3485
z    0.1164    0.3155    0.0679    0.0241    0.2319    -0.2845    -0.0503    -0.3152    0.0053
Mg x    -0.2168    -0.3659    -0.2006    0.1305    0.2718    0.0936    -0.0158    -0.1181    0.3193
y    0.2090    -0.1101    0.1629    0.2141    -0.1099    -0.1275    -0.1992    -0.2694    -0.0764
z    -0.1433    -0.0173    -0.0719    -0.3022    0.1703    -0.2951    0.1694    0.3162    0.0392
Mg x    0.2065    -0.1447    0.0137    -0.3303    -0.0273    0.1338    -0.3537    0.1331    -0.3750
y    -0.2023    -0.1207    0.1628    0.2055    -0.0954    -0.1321    -0.1720    0.2466    0.1066
z    -0.2003    0.1247    -0.2041    0.2106    -0.0267    -0.1993    -0.3353    0.3499    0.0793
Mg x    0.1039    -0.2655    -0.1017    -0.0999    0.1182    0.1148    -0.1843    -0.2949    0.0086
y    0.0852    -0.2105    0.0642    0.4456    0.0459    -0.1492    -0.0283    -0.0202    0.2625
z    0.1266    -0.2078    -0.3435    -0.1159    -0.0880    -0.2100    -0.1153    -0.3311    0.0396
Fe x    0.0058    -0.1595    0.0376    -0.0848    0.3321    0.1385    -0.2442    0.0030    0.0086
y    -0.0055    -0.2421    0.2989    0.0972    -0.0732    -0.2373    -0.0637    0.0063    0.0205
z    0.0834    0.0775    -0.2086    -0.0776    0.1107    -0.3759    -0.1184    -0.0234    -0.0115
怎么有这么多坐标？求详解。

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