孙希媛 更新日期:2024-07-04
孙希媛,女,1984年出生,学硕导师
工作单位 理学院
单位电话 0835-2886186
电子邮箱 sunxy@sicau.edu.cn
招生专业 【学硕】:0710Z1生物资源化学,【专硕】:086000生物与医药
◆研究领域
纳米材料的设计与合成,基于第一性原理方法结合电子密度分析手段研究纳米团簇、量子点与小分子的相互作用。
◆科研项目
[1] 氨基酸分子与黑磷烯量子点相互作用机制研究,四川省自然科学基金(No.2022NSFSC1824)主持
[2] 外场对Pd团簇吸附行为影响的理论研究,四川省教育厅项目 (No.15ZB0006), 主持
[3] 铀氧化物分子的结构与光谱,四川省教育厅项目(No.12ZB296),主持
◆发表论文
1) Xiyuan Sun*; Pengfei Yin; Yi Zhang; Chuanyu Zhang; Xing Feng; Gang Jiang, Efficient hydrogen storage capacity of La3B18: A DFT study, Int. J. hydrogen Energy, (2023) 8: 7807-7813.
2) Sun, Xiyuan*; Wang, Jian; Yin, Pengfei; Zhang, Yi; Wang, Kaiming; Jiang, Gang, H2O adsorption and O-H breaking on Co5M (M = Co, Y-Ag) clusters: A DFT study, J. Mol. Liq, (2022) 348: 118469.
3) Xiyuan Sun*, Yi Zhang, Pengfei Yin, Chuanyu Zhang, Xing Feng, Jian Wang, Point-defect engineering on phosphorene quantum dots for DNA bases adsorption and sensor performance, Mater. Today Commun, (2022) 33: 104868.
4) Sun, Xiyuan*; Yin, Pengfei; Wang, Kaiming; Jiang, Gang, CCSD(T) study on the structures and chemical bonds of AnO molecules (An=Bk–Lr), Chin. Phys. B, (2021) 30: 033101.
5) Sun, Xiyuan*; Wang, Kaiming; Yin, Pengfei; Zhang, Yi; Jiang, Gang, Magnetism, chemical bonding of Co5M clusters (M=Y-Ag), Eur. Phys. J. Plus, (2021) 136:294.
6) Sun, Xiyuan*; Wang, Kaiming; Yin, Pengfei; Zhang, Yi; Feng, Xing, Quasi-planar B50 sheet as a potential molecular sensor for NO2: A DFT study, Mater. Chem. Phys, (2021) 260:124104.
7) Zhou, Shengqiang; Sun, Xiyuan*; Jiang, Gang, A DFT study on the adsorption of nucleobases with Au20, J. Mol. Model, (2021) 27: 29.
8) Sun, Xiyuan*; Du, Jiguang; Zhao, Liang; Jiang, Gang, Water dissociation and H migration on metal decorated B40: A density functional theory (DFT) study, J. Mol. Liq, (2020) 315: 113759.
9) Sun, Xiyuan*; Cheng, Saisai; Feng, Xing, The detection of NH3 with M&B40 (M = Be, Mg) clusters, Ionics, (2019) 25:3413–3418.
10) Cheng, Saisai; Sun, Xiyuan*; Zhao, Liang; Chen, Jun, The interaction of guanine nucleobase with B40 borospherene, Eur. Phys. J. D, (2019) 73: 88.
◆指导学生
毕业4人,在读3人