Ten complexes between BeXY (X, Y = H, F, Cl, OH) and benzene have been optimized at the MP2/6-311 + G(3df, 2p) level. Our calculation indicates that there exist multicomponent nonbonded interactions. Analyses of the electron densities verify that the main stabilizing factor are BeΓΓΓp interactions.
β¦ LIBER β¦
Electronic structures, stabilities, and spectroscopies of the fullerene derivatives C68X4 (X = H, F, Cl)
β Scribed by Lei Xu; Xueguang Shao; Wensheng Cai
- Book ID
- 108286055
- Publisher
- Elsevier Science
- Year
- 2010
- Tongue
- English
- Weight
- 631 KB
- Volume
- 945
- Category
- Article
- ISSN
- 0166-1280
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Prediction and characterization of the B
β
Qiang Zhao; Dacheng Feng; Youmin Sun; Jingcheng Hao
π
Article
π
2011
π
Elsevier
π
English
β 461 KB
The evolutions of the structure stabilit
β
Chunmei Tang; Weihua Zhu; Kaiming Deng
π
Article
π
2009
π
Elsevier Science
π
English
β 911 KB
NMR espectroscopic parameters of HX and
β
Alejandro F. Maldonado; Carlos A. Gimenez; Gustavo A. Aucar
π
Article
π
2012
π
Elsevier Science
π
English
β 431 KB
Vibrational spectra and structural param
β
James R. Durig; Xiaohua Zhou; Nicole E. Durig; Diepngan Nguyen; Douglas T. Durig
π
Article
π
2009
π
Elsevier Science
π
English
β 620 KB
The coexistence curves of { x C6H5NO2&#x
β
Kai Tang; Congshan Zhou; Xueqin An; Weiguo Shen
π
Article
π
1999
π
Elsevier Science
π
English
β 158 KB
Coexistence curves of (T, n), (T, x), and (T, Ο) where n, x, and Ο are the refractive index, the mole fraction, and the volume fraction, respectively, for the binary mixtures {xC 6 H 5 NO 2 +(1x)CH 3 (CH 2 ) 4 CH 3 } and {xC 6 H 5 NO 2 +(1x)CH 3 (CH 2 ) 5 CH 3 } have been determined within about 10
Structural parameters, vibrational spect
β
James R. Durig; Sarah Xiaohua Zhou; Carmen Xiaomin Zhou; Nicole E. Durig
π
Article
π
2010
π
Elsevier Science
π
English
β 352 KB