An X-ray crystallographic study of [Xe2F3][SbF6] and dimorphism in [Xe2F3][AsF6]; and a density functional theory study of the Xe2F3+ cation

2000 ◽  
Vol 105 (1) ◽  
pp. 159-167 ◽  
Author(s):  
Barbara A. Fir ◽  
Michael Gerken ◽  
Bernard E. Pointner ◽  
Hélène P.A. Mercier ◽  
D.A. Dixon ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
X Ray ◽  
Crystallographic Study

ChemInform Abstract: An X-Ray Crystallographic Study of [Xe2F3][SbF6] and Dimorphism in [Xe2F3][AsF6]; and a Density Functional Theory Study of the Xe2F+3 Cation.

ChemInform ◽  
2000 ◽  
Vol 31 (48) ◽  
pp. no-no
Author(s):  
Barbara A. Fir ◽  
Michael Gerken ◽  
Bernard E. Pointner ◽  
Helene P. A. Mercier ◽  
D. A. Dixon ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
X Ray ◽  
Crystallographic Study

Crystal structure of radium sulfate: An X-ray powder diffraction and density functional theory study

2017 ◽  
Vol 253 ◽  
pp. 15-20 ◽  
Author(s):  
Artem V. Matyskin ◽  
Rikard Ylmen ◽  
Petra Lagerkvist ◽  
Henrik Ramebäck ◽  
Christian Ekberg
Keyword(s):  
Crystal Structure ◽  
Density Functional Theory ◽  
Powder Diffraction ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
X Ray ◽  
Radium Sulfate

scholarly journals Pressure-induced phase transformation in β-eucryptite: An X-ray diffraction and density functional theory study

2016 ◽  
Vol 122 ◽  
pp. 64-67 ◽  
Author(s):  
Yachao Chen ◽  
Sukriti Manna ◽  
Badri Narayanan ◽  
Zhongwu Wang ◽  
Ivar E. Reimanis ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Phase Transformation ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
X Ray Diffraction ◽  
Functional Theory ◽  
X Ray

2-(4-Hydroxyphenyl)-4,4-dimethyl-2-oxazoline: X-ray and density functional theory study

2006 ◽  
Vol 62 (7) ◽  
pp. o416-o418 ◽  
Author(s):  
Vratislav Langer ◽  
Dalma Gyepesová ◽  
Eva Scholtzová ◽  
Jozef Lustoň ◽  
Juraj Kronek ◽  
...  
Keyword(s):  
Density Functional Theory ◽  
Density Functional ◽  
Density Functional Theory Study ◽  
Functional Theory ◽  
X Ray
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