Density Functional Theory Investigations on the Geometric and Electronic Structures of 4–Azidomethyl–6–Isopropyl–2H–Chromen–2–One
We have employed first principle Density Functional Theory (DFT) investigations to study the physical and electronic properties of 4–Azidomethyl–6–isopropyl–2H–chromen–2–one, C13H13N3O2. Complete geometry optimization calculations were carried out to find local energy minimum of the molecular syst...
Saved in:
Main Authors: | Toh, Pek Lan, Meepripruk, Montha, Lee, Sin Ang, Sulaiman, Shukri, Mohamed Ibrahim, Mohamed Ismail |
---|---|
格式: | Article |
語言: | English |
出版: |
EDP Sciences
2015
|
主題: | |
在線閱讀: | http://eprints.usm.my/38619/1/Density_Functional_Theory_Investigations_on_the_Geometric_and_Electronic_Structures_of.pdf http://eprints.usm.my/38619/ http://dx.doi.org/10.1051/matecconf/20152701003 |
標簽: |
添加標簽
沒有標簽, 成為第一個標記此記錄!
|
相似書籍
-
First Principle Investigations On The Electronic Structure Of Graphene Nanoribbon And Its Interaction With Muonium
由: Ang , Lee Sin
出版: (2010) -
One-Way Random Effects Model For
Asymmetric Trimmed Means
由: Chin, Ee Laine
出版: (2019) -
First Principle Computational Studies On The Electronic Structure Of Muonated Κ-(Bedt-Ttf)2Cu[N(Cn)2]Cl And Κ-D8-(Bedt-Ttf)2Cu[N(Cn)2]Br
由: Hasan Baseri, Dang Fatihah
出版: (2022) -
JAA 582/2 - Pengurusan Binaan
由: PPJJ, Pusat Pengajian Jarak Jauh
出版: (2004) -
JKE 311 - MIKROEKONOMI 2 APRIL 08
由: PPJJ, Pusat Pengajian Jarak Jauh
出版: (2008)