Characterization and DFT studies of Cis, Trans and Vinyl Derivatives of 1,4-butadiene Using C20 in Different Temperatures
<strong> </strong>In this research of cis, trans and vinyl monomeric derivatives of 1,4-butadiene were studied using C<sub>20</sub> in different temperatures by Functional density theory (DFT). To this purpose, the materials were firstly optimized geometrically, then the calc...
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| Format: | Article |
| Language: | English |
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Iranian Chemical Science and Technologies Association
2018-04-01
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| Series: | International Journal of New Chemistry |
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| Online Access: | http://www.ijnc.ir/article_32910_8b4ff207ef748c0acbe3e4c071a8d577.pdf |