The structural and electronic properties of hydrogen–Cd vacancy complex in CdTe have been studied by using density functional theory. Three typical complexes between hydrogen and Cd vacancy were found in our present study. The stablest complex P 2 was predicted by using the formation energy and ...
Binding energy of hydrogen-bonded complexes of the chiral molecule 1-phenylethanol, as studied by 2C-R2PI: comparison between diastereoisomeric complexes w... Lahmani, Binding energy of hydrogen- bonded complexes of the chiral molecule 1-phenylethanol, as studied by 2C-R2PI: Comparison between ...
The binding energy of a hydrogen-like impurity in a thin size-quantized wire of the InSb/GaAs semiconductors with Kane's dispersion law in a magnetic fieldBparallel to the wire axis has been calculated as a function of the radius of the wire and magnitude ofB, using a variational approach....
We report the calculation of the binding energy Eof a screened hydrogen impurity placed at center of quantum well wire with a square cross-section of the length L, which is surrounded by an infinite barrier. The random-phase-approximation static dielectric function at zero temperature and electric...
In ionic clusters, we observe a decrease of hydrogen bond strength with an increasing number of aromatic rings in the chromophor, whereas the neutral binding energy increases in this case. 展开 关键词: Experimental/ binding energy hydrogen bonds molecular clusters organic compounds Rydberg states ...
the binding energy of H-2 on Sc2CO2 surface is the closest to the ideal range of 0.16-0.42 eV/H-2 at ambient conditions, and thus the Sc2C with... Q Hu,Q Wu,L Wang,... - 《International Journal of Hydrogen Energy》 被引量: 0发表: 2020年 Low-temperature motion of the scandium...
binding energybound stateelectric potentialenergy levelsgroup theoryhydrogenunitary symmetryGiven the chemical complexity of most environmental matrices, it seems ... A Luch,WM Baird - 《Comprehensive Toxicology》 被引量: 354发表: 2010年 Using green fluorescent protein to study intracellular signalling Sub...
ABS>An approximate analytic formula for the H/sup -/ photodetachment cross section recently obtained by Armstrong is used to obtain a value of the binding energy E/sub b/ of H/sup -/ from the Smith and Burch photodetachment data. The result of E/sub b/ = 0.77 plus or minus 0.02 ev...
Overall, the encapsulated metals increase the capacity and improve the energy efficiency for hydrogen storage. We identify materials capable of storing 6.1 wt % hydrogen and elucidate a subtle interplay between reactivity and structure which will be important for designing the next-generation hydrogen-...
结合能(Binding Energy)是分离原子核外不同亚层(Sublevel)的电子需要的能量。不同亚层的电子距离原子核的距离不一样,受到原子核的吸引力不一样,而想要从不同亚层分离电子所需要的能量就不一样。 “ AP化学考试热门考点光电子能谱(Photoelectron ...