Results for Point Group D29h



Force field analysis


Allowed / forbidden vibronational transitions
Operator A'1 A'2 E'1 E'2 E'3 E'4 E'5 E'6 E'7 E'8 E'9 E'10 E'11 E'12 E'13 E'14 A''1 A''2 E''1 E''2 E''3 E''4 E''5 E''6 E''7 E''8 E''9 E''10 E''11 E''12 E''13 E''14 Total
Linear (IR) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 / 1
Quadratic (Raman) 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 / 1
IR + Raman - - - - 0 - - - - - - - - 0 0 0 0 0 0 0 0 0 0 0 0 0 - - - - - - - - 0 0 0 0 0 0 0 - - - - 0 1 - - - - 0 0 0 / 1


Characters of force fields
(Symmetric powers of vibration representation)
Force field E 2C29 2(C29)2 2(C29)3 2(C29)4 2(C29)5 2(C29)6 2(C29)7 2(C29)8 2(C29)9 2(C29)10 2(C29)11 2(C29)12 2(C29)13 2(C29)14 29C'2 σh 2S29 2(S29)27 2(S29)3 2(S29)25 2(S29)5 2(S29)23 2(S29)7 2(S29)21 2(S29)9 2(S29)19 2(S29)11 2(S29)17 2(S29)13 2(S29)15 29σv
linear 2 -1.452 0.108 1.295 -1.988 1.592 -0.324 -1.122 1.953 -1.714 0.535 0.937 -1.895 1.815 -0.740 0 -2 1.452 -0.108 -1.295 1.988 -1.592 0.324 1.122 -1.953 1.714 -0.535 -0.937 1.895 -1.815 0.740 0
quadratic 3 1.108 -0.988 0.676 2.953 1.535 -0.895 0.260 2.815 1.937 -0.714 -0.122 2.592 2.295 -0.452 1 3 1.108 -0.988 0.676 2.953 1.535 -0.895 0.260 2.815 1.937 -0.714 -0.122 2.592 2.295 -0.452 1
cubic 4 -0.157 -0.215 -0.419 -3.884 0.852 0.613 0.831 3.545 -1.605 -0.917 -1.051 -3.018 2.350 1.075 0 -4 0.157 0.215 0.419 3.884 -0.852 -0.613 -0.831 -3.545 1.605 0.917 1.051 3.018 -2.350 -1.075 0
quartic 5 -0.880 0.965 -1.219 4.768 -0.179 0.697 -1.192 4.110 0.814 0.223 -0.863 3.127 1.971 -0.344 1 5 -0.880 0.965 -1.219 4.768 -0.179 0.697 -1.192 4.110 0.814 0.223 -0.863 3.127 1.971 -0.344 1
quintic 6 1.435 0.320 -1.159 -5.597 -1.136 -0.839 0.507 4.482 0.210 1.036 0.243 -2.909 1.228 -0.820 0 -6 -1.435 -0.320 1.159 5.597 1.136 0.839 -0.507 -4.482 -0.210 -1.036 -0.243 2.909 -1.228 0.820 0
sextic 7 -1.204 -0.930 -0.282 6.361 -1.631 -0.425 0.623 4.645 -1.174 0.331 1.091 2.387 0.257 0.951 1 7 -1.204 -0.930 -0.282 6.361 -1.631 -0.425 0.623 4.645 -1.174 0.331 1.091 2.387 0.257 0.951 1




Error: Reduction failed

Reduction to integer numbers for irreducible representations failed.
Error Code: 1

Decomposition to irreducible representations
Column with number of nonvanshing force constants highlighted
Force field A'1 A'2 E'1 E'2 E'3 E'4 E'5 E'6 E'7 E'8 E'9 E'10 E'11 E'12 E'13 E'14 A''1 A''2 E''1 E''2 E''3 E''4 E''5 E''6 E''7 E''8 E''9 E''10 E''11 E''12 E''13 E''14
linear
Characters of reducible representation
E 2C29 2(C29)2 2(C29)3 2(C29)4 2(C29)5 2(C29)6 2(C29)7 2(C29)8 2(C29)9 2(C29)10 2(C29)11 2(C29)12 2(C29)13 2(C29)14 29C'2 σh 2S29 2(S29)27 2(S29)3 2(S29)25 2(S29)5 2(S29)23 2(S29)7 2(S29)21 2(S29)9 2(S29)19 2(S29)11 2(S29)17 2(S29)13 2(S29)15 29σv
0 -1.452 0.108 1.295 -1.988 1.592 -0.324 -1.122 1.953 -1.714 0.535 0.937 -1.895 1.815 -0.740 0 -2 1.452 -0.108 -1.295 1.988 -1.592 0.324 1.122 -1.953 1.714 -0.535 -0.937 1.895 -1.815 0.740 0