节点文献
丙烷分子的价轨道(2b2)电子的动量分布测量
Measurement of Momentum Profiles for Propane Valence Orbitals(2b2)
【Abstract】 We report here the first measurements of momentum profiles for the propane (C3H8)valence orbitals using high resolution (△E=0.9 eV FWHM, △p=0.1 a.u.) (e,2e) electron momentum spectrometer. The impact energy was 1200 eV with binding energy l206 to 1232 eV andsymmetric non-coplanar kinematics was employed. The inner-valence spectrum is in agreementwith published photoelectron data. Excited ionic states corresponding to many-body electron correlation processes were observed for propane above 25 eV. The expeyimental momentum profileswere compared with calculations obtained using Hartree-Fock method with the minimum basis setand a high-level basis set, and also using density functional theory (DFT) local density and nonlocal density methods with a high level basis set. The agreement between theory and experimentfor the shape of orbital electron momentum distributions is generally good.
- 【文献出处】 物理化学学报 ,ACTA PHYSICO-CHIMICA SINICA , 编辑部邮箱 ,1998年10期
- 【分类号】O641
- 【被引频次】2
- 【下载频次】22