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121.
Multi-reference configuration-interaction calculations on multiply charged ions of carbon monosulfide 下载免费PDF全文
The potential energy curves for neutrals and multiply charged ions of carbon monosulfide are computed with highly correlated multi-reference configuration interaction wavefunctions.The correlations of inner-shell electrons with the scalar relativistic effects are included in the present computations.The spectroscopic constants,dissociation energies,ionization energies for ground and low-lying excited states together with corresponding electronic configurations of ions are obtained,and a good agreement between the present work and existing experiments is found.No theoretical evidence is found for the adiabatically stable CSq+(q>2) ions according to the present ab initio calculations.The calculated values for 1st-6th ionization energies are 11.25,32.66,64.82,106.25,159.75,and 224.64 eV,respectively.The kinetic energy release data of fragments are provided by the present work for further experimental comparisons. 相似文献
122.
采用电感耦合等离子体发射原子发射光谱法(ICP-AES)测定了电解镍中锰、磷、钴、铁、铜、镁、铝、锌、镉、硅和锡等11种元素的含量,对仪器各项参数进行优化,采用基体匹配办法克服基体干扰,通过选择合适的分析谱线和背景校正消除共存元素间干扰。方法应用于实际样品分析,11种元素的回收率为92.0%—107.0%,相对标准偏差0.3%—5.1%,测定结果与标准方法的测定值相符。 相似文献
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124.
Nonaqueous rechargeable lithium-air battery has so high specific capacity and specific energy that it is being widely researched by academia, corporation, and different research institutes. When used in dried air and absorbing oxygen form the air, this battery is called lithium-air battery, and its specific capacity based on cathode active material (oxygen) is infinite. However, its cycle performance is very limited as reported by the state-of-the-art researches. This cycle problem is mainly caused by instability of electrolyte. Based on electroanalysis of materials’ electrochemical property, a stable electrolyte solvent (sulfolane) and a lithium salt LiBF4 are selected as electrolytes in this work. Coupled with other eligible battery materials and careful assembly, the lithium-air battery exhibits favorable cycle performance. Above all, this lithium-air system is evaluated objectively in this paper. 相似文献
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127.
We propose a scheme for generating a hyperentangled four-photon cluster state that is simultaneously entangled in polarization modes and spatial modes. This scheme is based on linear optical elements, weak cross-Kerr nonlinearity, and homodyne detection. Therefore, it is feasible with current experimental technology. 相似文献
128.
Yi-you Nie Yue Xu Yuan-hua Li Ming-huang Sang 《International Journal of Theoretical Physics》2014,53(4):1299-1307
We present a scheme for implementing the deterministic quantum state sharing of an arbitrary three-atom state by using a five-atom cluster state and a Bell-state in cavity QED. In the scheme, it does not involve Bell-state measurement and only needs to perform the single-atom measurements. Our scheme is not sensitive to both the cavity decay and the atom radiation, which is of importance in view of decoherence. 相似文献
129.
First-principles investigation of chemical modification on two-dimensional iron–phthalocyanine sheet 下载免费PDF全文
Successful synthesis of single iron–phthalocyanie(FePc) framework layer on substrate and its transferrable properties open the door for decorating the separately distributed transition metals for exploring the diverse properties. We have studied the effects of chemical modification on two-dimensional FePc organometallic framework with density functional theory. For simplicity, the non-metal atoms with variant valence electrons are used as prototypes to estimate the effects from chemical modifications with different functional groups. The thermo-stabilities of the non-metal atom decorated complex sheet materials have been estimated by the first-principles constant energy molecular dynamic simulations. Upon the nonmetal atom adsorption, the magnetic moment could be changed from 2 μBto 0, 1, 2, and 3 μBper unit cell for the case of tetra-, penta-, hexa-, and hepta-valent non-metal modifications, respectively, showing interesting promise to tailor its magnetic properties for potential applications. 相似文献
130.
We study quasinormal modes of scalar field perturbation and electromagnetic field perturbation in a black hole space-time with dark matter by using WKB approximation method. The result shows clearly that the real part of black hole quasinormal modes is mainly determined by angular quantum number while its imaginary part mainly determined by model number. We also found out that the dark matter will restrain the perturbation frequency and slow down the speed of damping in spacetime. In addition; dark matter has a greater influence upon quasinormal modes in the electromagnetic field than that in the scalar field. 相似文献