AB INITIO COMPUTATIONAL STUDY ON AROMATICITY OF PYRROLE, FURAN AND TIOPHENE RADICAL BY HARTREE FOCK METHOD
Computational study is used to determine aromaticity in radical compounds of furan, pyrrole and tiophene. These calculations are supported by GAMESS (General Atomic Molecular Electronic Structure System) program. In these research, some properties of the radicals such as molecular geometry optimizat...
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| Format: | Final Project |
| Language: | Indonesia |
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| Online Access: | https://digilib.itb.ac.id/gdl/view/34859 |
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| Institution: | Institut Teknologi Bandung |
| Language: | Indonesia |