科学研究：长期从事分子模拟、高性能计算、人工智能和大数据的研究与应用；

教育技术：长期从事教学的数字化和智能化理论研究和工具开发，以提升学生的数字化学习、研发和管理能力。

(37) Ning Wang*, Siyu Gan, Guiling He, Qinqin Wei, Yupin Ji, Shijian Wang, Xihao Chen, Guangzhao Wang, Zhehao Sun, Jia Fu*,Effect of hydrostatic pressure on thermal transport properties of Tl3XSe4 (X= V, Ta, Nb): A First-Principles study, Results in Physics,56, 107309 (2024)

(36) L. Liu, Z. Yang, J. Fu*, and Z. Wan, Investigations on the Local Structure and the Spin Hamiltonian Parameters for Cu ²⁺ in x CuO−(68− x )V ₂ O ₅ −32TeO ₂ Glasses, Magnetic Reson in Chemistry 61, 40 (2023).

(35) Zhangzhang Yang, Zhitao Wan, Li Liu, Jia Fu*, Qunchao Fan*, Feng Xie, Yi Zhang and Jie Ma, “Achieving vibrational energies of diatomic systems with high quality by machine learning improved DFT method”, RSC Advances, 2022, 12, 35950.

(34) Qunchao Fan, Jun Jian, Zhixiang Fan*, Jia Fu*, Huidong Li, Jie Ma, Feng Xie, “A method for predicting the molar heat capacities of HBr and HCl gases based on the full set of molecular rovibrational energies”, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2022, 267, 120564. 

(33) Zhixiang Fan, JieJie He, Zhizhang Ni, Qunchao Fan*, Jia Fu*, Yonggen Xu, Huidong Li, Jie Ma, Feng Xie, “A data- and model-driven strategy for the evaluation of the experimental transition lines: Theoretical prediction for the ground state of ¹²C¹⁶O”, Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2022, 264, 120278.

(32) Jia Fu, Zhitao Wan, Zhangzhang Yang, Li Liu,Qunchao Fan,Feng Xie, Yi Zhang and Jie Ma, “Combining ab initio and machine learning method to improve the prediction of diatomic vibrational energies”, International Journal of Quantum Chemistry, 2022, 122, e26953.

(31) Fu, J.; Jian, J.; Long, S.; Fan, Z.; Fan, Q.; Xie, F.; Zhang, Y.; Ma, J. Study on potential energy curves and ro-vibrational energies of DT, HT and T2 molecules. Spectrochim. Acta. A. Mol. Biomol. Spectrosc.2021, 119913.https://doi.org/10.1016/j.saa.2021.119913.

(30) Fu, J.; Long, S.; Jian, J.; Fan, Z.; Fan, Q.; Xie, F.; Zhang, Y.; Ma, J. A Joint Data and Model Driven Method for Study Diatomic Vibrational Spectra Including Dissociation Behavior. Spectrochim. Acta. A. Mol. Biomol. Spectrosc.2020, 118363. https://doi.org/10.1016/j.saa.2020.118363.

(29)  Zhang, Y.; Sun, W.; Fu, J.; Fan, Q.; Ma, J.; Xiao, L.; Jia, S. Method for Studying Diatomic Rovibrational Spectra at a given Vibrational State. Sci. China-Phys. Mech. Astron.2019, 62 (4), 943011. https://doi.org/10.1007/s11433-018-9311-3.

(28)  Sun, W.; Zhang, Y.; Fu, J.; Zhang, Z.; Wu, W.; Tang, Y. Studying Chemical Reaction Rate Using a Difference Algebraic Converging Method— A Study on the Thermal Decomposition of Poly-α-Methyl Styrene. Polym. Degrad. Stab.2019, 170, 109011. https://doi.org/10.1016/j.polymdegradstab.2019.109011.

(27)  Fan, Q.; Li, H.; Fu, J.; Fang, Z.; Xu, Y.; Feng, H.; Xie, Y.; King, R. B.; Schaefer, H. F. Tris(Butadiene) Metal Complexes of the First-Row Transition Metals versus Coupling of Butadiene to Eight- and Twelve-Carbon Hydrocarbon Chains. J. Phys. Chem. A2019, 123 (26), 5542–5554. https://doi.org/10.1021/acs.jpca.9b03063.

(26)  Sun, W.; Fan, Z.; Zhang, Y.; Fu, J.; Hu, S.; Zhang, L.; Fan, Q. Predicting Rosseland Mean Opacities of Aluminum Using a Difference Converging Method. J. Quant. Spectrosc. Radiat. Transf.2018, 204, 35–41. https://doi.org/10.1016/j.jqsrt.2017.09.004.

(25)  Hu, S.; Sun, W.; Fu, J.; Zhang, Z.; Wu, W.; Tang, Y. Initiation Mechanisms and Kinetic Analysis of the Isothermal Decomposition of Poly(Alpha-Methylstyrene): A ReaxFF Molecular Dynamics Study. Rsc Adv.2018, 8 (7), 3423–3432. https://doi.org/10.1039/c7ra12467h.

(24)  Fan, Z.; Sun, W.; Zhang, Y.; Fu, J.; Hu, S.; Fan, Q. Radiative Opacities of Iron Using a Difference Algebraic Converging Method at Temperatures near Solar Convection Zone. Phys. Plasmas2018, 25 (3), 033301. https://doi.org/10.1063/1.5017787.

(23)  Fan, Q.; Hu, C.; Fu, J.; Ma, J.; Fan, Z.; Xu, Y.; Li, H.; Zhang, Y. An Analytical Formula for Predicting R-Branch High-Lying Transition Lines of BiLi Molecule. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2018, 200, 290–297. https://doi.org/10.1016/j.saa.2018.03.082.

(22)  Fan, Q.; Fu, J.; Li, H.; Feng, H.; Sun, W.; Xie, Y.; King, R. B.; Schaefer, H. F. Butadiene as a Ligand in Open Sandwich Compounds. Phys. Chem. Chem. Phys.2018, 20 (8), 5683–5691. https://doi.org/10.1039/c7cp07379h.

(21)  Hu, S.; Sun, W.; Fu, J.; Zhang, L.; Fan, Q.; Zhang, Z.; Wu, W.; Tang, Y. Reactive Molecular Dynamics Simulations on the Thermal Decomposition of Poly Alpha-Methyl Styrene. J. Mol. Model.2017, 23 (6), 179. https://doi.org/10.1007/s00894-017-3342-8.

(20)  Fu, J.; Zhan, J.; Fan, Q. C.; Li, H. D.; Fan, Z. X.; Xu, Y. G. Regularized Vibrational Energies Prediction and Potential Energy Function Study for Some Interhalogen Diatomic Molecules. J. Theor. Comput. Chem.2017, 16 (6), 1750047. https://doi.org/10.1142/S021963361750047X.

(19)  Fu, J.; Feng, H.; Zhang, Y. The Impact of Vibrational Wave Function on Low Energy Electron Vibrational Scattering from Nitrogen Molecule. Chin. Phys. B2017, 26 (8), 083401. https://doi.org/10.1088/1674-1056/26/8/083401.

(18)  Fu, J.; Fan, Q.; Liu, G.; Li, H.; Xu, Y.; Fan, Z.; Zhang, Y. Influence of Different Micro-Vibrational Behavior on the Thermodynamic Properties of SO Gas. Comput. Theor. Chem.2017, 1115, 136–143. https://doi.org/10.1016/j.comptc.2017.06.014.

(17)  Fan, Q.; Fan, Z.; Sun, W.; Zhang, Y.; Fu, J. Vibrational Spectra and Analytical Potential Energy Functions of Some Electronic States of Na-2. Can. J. Phys.2017, 95 (3), 253–261. https://doi.org/10.1139/cjp-2015-0579.

(16)  Chun-guo, Z.; Qun-chao, F.; Yu-lu, W.; Jia, F.; Zhi-xiang, F. P-Branch Transitonal Spectral Lines of High-Lying Rovibrational States of Cl-2(+) Ion. Spectrosc. Spectr. Anal.2017, 37 (9), 2703–2711. https://doi.org/10.3964/j.issn.1000-0593(2017)09-2703-09.

(15)  Zhang, C. G.; Fan, Q. C.; Fan, Z. X.; Li, H. D.; Fu, J. High-Lying Vibrational Energies and Analytical Potential Energy Functions for Some Electronic States of Diatomic Ions. J. Theor. Comput. Chem.2016, 15 (2), 1650014. https://doi.org/10.1142/S0219633616500140.

(14)  Yong-Hong, J.; Wei-Guo, S.; Yi, Z.; Jia, F.; Qun-Chao, F. R-branch and Q-branch high rotational spectral lines of diatomic molecules using improved difference converging method. Acta Phys. Sin.2016, 65 (7), 070202. https://doi.org/10.7498/aps.65.070202.

(13)  Jiang, Y.; Sun, W.; Zhang, Y.; Fu, J.; Fan, Q.; Li, H.; Feng, H. Studying the R-Branch and the Q-Branch Emission Spectral Lines of Diatomic Molecules Using Improved Analytical Formula. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2016, 162, 1–5. https://doi.org/10.1016/j.saa.2016.02.024.

(12)  Jiang, Y.; Sun, W.; Zhang, Y.; Fu, J.; Fan, Q.; Li, H.; Feng, H. Prediction of P-Branch Emission Spectral Lines of NaF and (CuCl)-Cu-63-Cl-35 Molecules. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2016, 153, 87–93. https://doi.org/10.1016/j.saa.2015.08.001.

(11)  Xiao-Feng, Z.; Qun-Chao, F.; Wei-Guo, S.; Zhi-Xiang, F.; Yi, Z.; Jia, F.; Bo, L. Full vibrational spectra of some electronic states of NaLi molecule using a difference converging method. Acta Phys. Sin.2015, 64 (20), 203301. https://doi.org/10.7498/aps.64.203301.

(10)  Zhang, Y.; Sun, W.; Fu, J.; Fan, Q.; Ma, J.; Xiao, L.; Jia, S.; Feng, H.; Li, H. A Variational Algebraic Method Used to Study the Full Vibrational Spectra and Dissociation Energies of Some Specific Diatomic Systems. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2014, 117, 442–448. https://doi.org/10.1016/j.saa.2013.08.043.

(9)  Sun, W.; Zhang, Y.; Fan, Q.; Feng, H.; Fu, J.; Li, H.; Ma, J.; Xiao, L.; Jia, S. Hidden Physics in Molecular Rovibrational Spectrum. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2014, 132, 32–37. https://doi.org/10.1016/j.saa.2014.04.137.

(8)  Fu, J.; Zhu, B.; Zhang, Y.; Feng, H.; Sun, W. The Impact of Diffuse Orbitals on Low Energy Electron Vibrational Scattering from a Nitrogen Molecule. J. Phys. B-At. Mol. Opt. Phys.2014, 47 (19), 195203. https://doi.org/10.1088/0953-4075/47/19/195203.

(7)  Fu, J.; Sun, W.; Jiang, Y.; Fan, Q.; Zhang, Y.; Zhang, Z. A Molecular Based Kinetic Study on the Thermal Decomposition of Poly-Alpha-Methyl Styrene. Polym. Degrad. Stab.2014, 110, 415–421. https://doi.org/10.1016/j.polymdegradstab.2014.10.002.

(6)  Zhang, Y.; Sun, W.; Fu, J.; Fan, Q.; Ma, J.; Xiao, L.; Jia, S.; Feng, H.; Li, H. Dealing with the Hidden Unphysical Constraint and the Butterfly Effect in Spectrum Computations. J. Quant. Spectrosc. Radiat. Transf.2013, 120, 81–89. https://doi.org/10.1016/j.jqsrt.2013.02.018.

(5)  Yong-Hong, J.; Wei-Guo, S.; Yi, Z.; Jia, F.; Qun-Chao, F.; Hui-Dong, L.; Hao, F. Study on P-branch emission spectral lines of AuO molecule using improved analytical formula. Acta Phys. Sin.2013, 62 (21), 213301. https://doi.org/10.7498/aps.62.213301.

(4)  Jia, F.; Qun-Chao, F.; Wei-Guo, S.; Shi, H.; Yong-Hong, J. Studies on the R-branch emission spectral lines of VN molecules. Acta Phys. Sin.2013, 62 (23), 233301. https://doi.org/10.7498/aps.62.233301.

(3)  Yi, Z.; Wei-guo, S.; Jia, F.; Qun-chao, F.; Hao, F.; Hui-dong, L. Vibrational Levels and Dissociation Energies of Diatomic Systems Using Algebraic Method. Spectrosc. Spectr. Anal.2012, 32 (1), 15–19. https://doi.org/10.3964/j.issn.1000-0593(2012)01-0015-05.

(2)  Yi, Z.; Wei-Guo, S.; Jia, F.; Qun-Chao, F.; Hao, F.; Hui-Dong, L. Investigations of vibrational levels and dissociation energies of diatomic systems using a variational algebraic method. Acta Phys. Sin.2012, 61 (13), 133301.

(1)  Fu, J.; Sun, W.; Li, H.; Fan, Q.; Zhang, Y.; Feng, H. Studies on the Q-Branch Spectral Lines of High-Lying Rovibrational Transitions of Diatomic System. Spectrochim. Acta Part -Mol. Biomol. Spectrosc.2012, 91, 244–247. https://doi.org/10.1016/j.saa.2012.01.076.

课程建设：

本科课程：

     《理论力学》西华大学线下一流课程。

研究生课程：

    《高等量子力学》、《数据管理与机器学习》。

参与授课：

本科课程：

    《科学技术发展简史与前沿》、《大学物理A》。

教学改革：

主持：   

    西华大学校级重点教改项目：《基于证据的通识教育内容选择研究-以物理为例》

主研：

    四川省教改项目：《基于大数据和机器学习的多维度平时成绩量化考核探索》

1.中国建筑节能协会低碳涂料专委会副秘书长

2.香港城市大学成都研究院人工智能中心研究员。