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In this final project the calculation of vibration mode of molecule AB2 with point group C2v and molecule AB4 with point group Td has been performed. The H2O molecule and GeF4 molecule are selected for AB2 and AB4 structure, respectively. The calculation of vibrational spectrum of these molecules ar...
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| Main Author: | |
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| Format: | Final Project |
| Language: | Indonesia |
| Online Access: | https://digilib.itb.ac.id/gdl/view/15433 |
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| Institution: | Institut Teknologi Bandung |
| Language: | Indonesia |
| Summary: | In this final project the calculation of vibration mode of molecule AB2 with point group C2v and molecule AB4 with point group Td has been performed. The H2O molecule and GeF4 molecule are selected for AB2 and AB4 structure, respectively. The calculation of vibrational spectrum of these molecules are carried out by means of GF Matrix. The GF matrix formulation is represented in the internal coordinate which is obtained from cartesian coordinate by using the steele’s vector. Furthermore the formulation of GF matrix is described by the symmetry coordinate using the symmetry of the molecule. By diagonalizing GF matrix, the values of normal frequencies and their type of vibration modes of the molecule can be obtained. |
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