Vibrational Modes of naphthalene


Level of Theory : B3LYP/6-31G(d,p)


Scale Factor : 0.961


Frequency unit : 1/cm

 


1                A"        176.7
Scaled : 169.8
2                A"        189.7
Scaled : 182.3
3                A'        364.0
Scaled : 349.8

4                A"        397.1
Scaled : 381.6
5                A"        481.4
Scaled : 462.6
6                A"        491.9
Scaled : 472.7

7                A'        517.8
Scaled : 497.6
8                A'        520.4
Scaled : 500.1
9                A"        633.8
Scaled : 609.0

10                A'        634.9
Scaled : 610.2
11                A"        735.2
Scaled : 706.5
12                A'        775.6
Scaled : 745.4

13                A"        784.5
Scaled : 753.9
14                A"        803.6
Scaled : 772.2
15                A'        807.5
Scaled : 776.0

16                A"        853.8
Scaled : 820.5
17                A"        899.4
Scaled : 864.3
18                A'        947.9
Scaled : 910.9

19                A"        952.0
Scaled : 914.9
20                A"        968.7
Scaled : 930.9
21                A"        989.2
Scaled : 950.7

22                A"        997.2
Scaled : 958.3
23                A'        1042.9
Scaled : 1002.3
24                A'        1053.6
Scaled : 1012.5

25                A'        1154.6
Scaled : 1109.6
26                A'        1177.4
Scaled : 1131.5
27                A'        1178.1
Scaled : 1132.2

28                A'        1189.2
Scaled : 1142.8
29                A'        1240.9
Scaled : 1192.5
30                A'        1273.0
Scaled : 1223.4

31                A'        1291.8
Scaled : 1241.4
32                A'        1407.8
Scaled : 1352.9
33                A'        1414.7
Scaled : 1359.5

34                A'        1425.0
Scaled : 1369.4
35                A'        1501.5
Scaled : 1442.9
36                A'        1502.7
Scaled : 1444.1

37                A'        1562.6
Scaled : 1501.6
38                A'        1627.8
Scaled : 1564.3
39                A'        1655.7
Scaled : 1591.2

40                A'        1686.3
Scaled : 1620.5
41                A'        3172.6
Scaled : 3048.9
42                A'        3175.9
Scaled : 3052.0

43                A'        3176.2
Scaled : 3052.4
44                A'        3179.7
Scaled : 3055.7
45                A'        3191.2
Scaled : 3066.8

46                A'        3192.5
Scaled : 3068.0
47                A'        3204.5
Scaled : 3079.5
48                A'        3205.5
Scaled : 3080.5

These movies were created by Mohamad Kassaee and David Keffer in the Department of Chemical Engineering at the University of Tennessee, using a combination of Gaussian98 and home-made codes. Please do not reproduce them without our consent. We can be reached via email at dkeffer@utk.edu.