Elastic Electron Collisions with Cyanoacetylene

被引:0
|
作者
da Mata, Victor A. S. [1 ]
Moreira, Giseli M. [2 ,3 ]
da Silva, Adevania J. [1 ]
da Costa, Romarly F. [4 ]
Mendes, Luiz A. V. [5 ]
Homem, Manoel G. P. [1 ]
机构
[1] Univ Fed Sao Carlos, Dept Quim, BR-13565905 Sao Carlos, SP, Brazil
[2] Univ Estadual Centro Oeste, Dept Fis, BR-85040167 Guarapuava, PR, Brazil
[3] Univ Fed Parana, Dept Fis, BR-81531980 Curitiba, PR, Brazil
[4] Univ Fed ABC, Ctr Ciencias Nat & Humanas, BR-09210580 Santo Andre, SP, Brazil
[5] Univ Fed Fluminense, Dept Ciencias Exatas Biol & Terra, BR-28470000 Santo Antonio De Padua, RJ, Brazil
来源
ACS PHYSICAL CHEMISTRY AU | 2025年
基金
巴西圣保罗研究基金会;
关键词
elastic electron collisions; cyanoacetylene; cross sections; shape resonances; Schwingermultichannelmethod; Schwinger variational method; relative flowtechnique; CROSS-SECTIONS; SCREENING CORRECTIONS; APPEARANCE ENERGIES; OPTICAL-MODEL; AMINO-ACIDS; SCATTERING; ATOMS; PHOTOIONIZATION; IRRADIATION; IONIZATION;
D O I
10.1021/acsphyschemau.5c00006
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
A comprehensive theoretical investigation involving electron collisions with cyanoacetylene is reported. Differential cross sections (DCSs), integral cross sections (ICSs), and momentum-transfer cross sections (MTCSs) for the elastic electron scattering were calculated using the Schwinger multichannel (SMC) method at the static-exchange plus polarization (SEP) level of approximation for energies ranging from 0.5 to 30 eV. The Schwinger variational method combined with Pade's approximants (SVPA), considering static-exchange-polarization plus absorption (SEPA), was also applied for impact energies from 0.1 to 1000 eV. These results were complemented by calculations performed according to the screen-corrected independent atom model (SCIAM). Furthermore, original measurements of absolute elastic (DCSs) at 20 eV were conducted in a crossed-beam apparatus. The theoretical results display an outstanding agreement with each other and an overall agreement with the calculated cross sections available in the literature. The agreement between the calculated and measured results is quite encouraging, further validating the thoroughness of the current research.
引用
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页数:10
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