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快速氢原子与原子氦碰撞截面计算
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作者 单鸿鸣 《台州师专学报》 1999年第6期29-36,共8页
应用量子力学第一玻恩近似和氢原子与氦原子的解析波函数,计算了它们弹性碰撞和各种非弹性碰撞截面。
关键词 氢原子 氦原子 弹性碰撞截面 弹性碰撞截面
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Elastic Collisions Between two Ground-State P and D Atoms at Low and Ultralow Temperatures
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作者 施德恒 张金平 +3 位作者 孙金锋 马恒 刘玉芳 朱遵略 《Communications in Theoretical Physics》 SCIE CAS CSCD 2010年第2期331-338,共8页
The PD(X^3∑^-) interaction potential is constructed using the CCSD(T) theory and the basis set, augcc-pV5Z. Using this potential, the spectroscopic parameters are accurately determined. The present Do, De, Re, ω... The PD(X^3∑^-) interaction potential is constructed using the CCSD(T) theory and the basis set, augcc-pV5Z. Using this potential, the spectroscopic parameters are accurately determined. The present Do, De, Re, ωe, ωeχe, αe, and Be are of 3.056 99 eV, 3.161 75 eV, 0.142 39 nm, 1701.558 cm^-1, 23.6583 cm^-1, 0.085 99 cm^-1, and 4.3963 cm^-1, respectively, which almost perfectly conform with the measurements. A total of 26 vibrational states is predicted when J = 0 by solving the radial Sehrodinger equation of nuclear motion. The complete vibrational levels, classical turning points, initial rotation and centrifugal distortion constants when J = 0 are reported for the first time, which favorably agree with the experiments. The total and various partial-wave cross sections are calculated for the elastic impact between two ground-state P and D atoms at 1.0 × 10^-12 - 1.0 × 10^-4 a.u. when they approach each other along the PD(X^3∑^-) potential. No shape resonances exist in the total elastic cross sections, though the peaks can be found for each partial wave until l=6. The shape of the total elastic cross sections is dominated by the s partial wave at very low temperatures. Due to the weakness of the shape resonances of each partial wave, they are all passed into oblivion by the strong total elastic cross sections. 展开更多
关键词 elastic scattering total cross section shape resonance molecular constant
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