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Theoretical and experimental investigation of electron collisions with acetone
被引:11
|作者:
Homem, M. G. P.
[1
]
Iga, I.
[1
]
da Silva, L. A.
[1
]
Ferraz, J. R.
[2
]
Machado, L. E.
[2
]
de Souza, G. L. C.
[3
]
da Mata, V. A. S.
[3
]
Brescansin, L. M.
[4
]
Lucchese, R. R.
[5
]
Lee, M. -T.
[1
]
机构:
[1] Univ Fed Sao Carlos, Dept Quim, BR-13565905 Sao Paulo, Brazil
[2] Univ Fed Sao Carlos, Dept Fis, BR-13565905 Sao Paulo, Brazil
[3] Univ Fed Mato Grosso, Dept Quim, BR-78060900 Cuiaba, MG, Brazil
[4] Univ Estadual Campinas, Inst Fis Gleb Wataghin, BR-13083970 Sao Paulo, Brazil
[5] Texas A&M Univ, Dept Chem, College Stn, TX 77842 USA
来源:
PHYSICAL REVIEW A
|
2015年
/
92卷
/
03期
基金:
巴西圣保罗研究基金会;
关键词:
DIFFERENTIAL CROSS-SECTIONS;
LOW-ENERGY;
VIBRATIONAL-EXCITATION;
POLYATOMIC-MOLECULES;
ELASTIC-SCATTERING;
FORMALDEHYDE;
IMPACT;
IONIZATION;
ACETALDEHYDE;
NITROGEN;
D O I:
10.1103/PhysRevA.92.032711
中图分类号:
O43 [光学];
学科分类号:
070207 ;
0803 ;
摘要:
We report a joint theoretical-experimental investigation on elastic electron scattering by acetone in the low-and intermediate-energy regions. More specifically, experimental differential, integral, and momentum-transfer cross sections are given in the 30-800 eV and 10 degrees-120 degrees ranges. Theoretical cross sections are reported in the 1-500 eV interval. The experimental differential cross sections were determined using a crossed electron-beam-molecular-beam geometry, whereas the absolute values of the cross sections were obtained using the relative-flow technique. Theoretically, a complex optical potential derived from a Hartree-Fock molecular wave function was used to represent the collision dynamics, and a single-center expansion method combined with the Pade approximant technique was used to solve the scattering equations. Our experimental cross-section data are in generally good agreement with the present calculated data. Also, our calculated grand-total and total absorption cross sections are in good agreement with the experimental results reported in the literature. Nevertheless, our calculations have revealed a strong shape resonance in the B-2(2) scattering channel not clearly seen in the experimental results. Possible reasons for this fact are also discussed.
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页数:8
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