Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method

doi:10.1088/1674-1056/ac21c3

中国物理B ›› 2022, Vol. 31 ›› Issue (1): 10202-010202.doi: 10.1088/1674-1056/ac21c3

Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method

Yiao Wang(王亦傲), Zhenpeng Wang(王振鹏), Maomao Gong(宫毛毛)^†, Chunkai Xu(徐春凯), and Xiangjun Chen(陈向军)

Hefei National Laboratory for Physical Sciences at Microscale and Department of Modern Physics, University of Science and Technology of China, Hefei 230026, China

收稿日期:2021-07-12 修回日期:2021-08-24 接受日期:2021-08-27 出版日期:2021-12-03 发布日期:2021-12-23
通讯作者: Maomao Gong E-mail:gongmm@ustc.edu.cn
基金资助:
Project supported by the National Natural Science Foundation of China (Grant Nos. 12004370, 11534011, and 11934004) and the National Key Research and Development Program of China (Grant Nos. 2017YFA0402300 and 2019YFA0210004).

Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method

Yiao Wang(王亦傲), Zhenpeng Wang(王振鹏), Maomao Gong(宫毛毛)^†, Chunkai Xu(徐春凯), and Xiangjun Chen(陈向军)

Hefei National Laboratory for Physical Sciences at Microscale and Department of Modern Physics, University of Science and Technology of China, Hefei 230026, China

Received:2021-07-12 Revised:2021-08-24 Accepted:2021-08-27 Online:2021-12-03 Published:2021-12-23
Contact: Maomao Gong E-mail:gongmm@ustc.edu.cn
Supported by:
Project supported by the National Natural Science Foundation of China (Grant Nos. 12004370, 11534011, and 11934004) and the National Key Research and Development Program of China (Grant Nos. 2017YFA0402300 and 2019YFA0210004).

摘要/Abstract

摘要： We report theoretical studies of electron impact triple differential cross sections of two bio-molecules, pyrimidine and tetrahydrofurfuryl alcohol, in the coplanar asymmetric kinematic conditions with the impact energy of 250 eV and ejected electron energy of 20 eV at three scattering angles of -5 °, -10 °, and -15 °. Present multi-center distorted-wave method well describes the experimental data, which was obtained by performing (e, 2e) experiment. The calculations show that the secondary electron produced by the primary impact electron is strongly influenced by the molecular ionic multi-center potential, which must be considered when the low energy electron interacts with DNA analogues.

关键词: (e, 2e), bio-molecules, multi-center distorted-wave method (MCDW)

Abstract: We report theoretical studies of electron impact triple differential cross sections of two bio-molecules, pyrimidine and tetrahydrofurfuryl alcohol, in the coplanar asymmetric kinematic conditions with the impact energy of 250 eV and ejected electron energy of 20 eV at three scattering angles of -5 °, -10 °, and -15 °. Present multi-center distorted-wave method well describes the experimental data, which was obtained by performing (e, 2e) experiment. The calculations show that the secondary electron produced by the primary impact electron is strongly influenced by the molecular ionic multi-center potential, which must be considered when the low energy electron interacts with DNA analogues.

Key words: (e, 2e), bio-molecules, multi-center distorted-wave method (MCDW)

中图分类号: (Computational techniques; simulations)

02.70.-c

03.65.-w (Quantum mechanics) 03.65.Nk (Scattering theory)

Yiao Wang(王亦傲), Zhenpeng Wang(王振鹏), Maomao Gong(宫毛毛), Chunkai Xu(徐春凯), and Xiangjun Chen(陈向军). Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method[J]. 中国物理B, 2022, 31(1): 10202-010202.

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Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method

Theoretical study of (e, 2e) triple differential cross sections of pyrimidine and tetrahydrofurfuryl alcohol molecules using multi-center distorted-wave method

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