Ø基于机器学习的合金材料理论模拟与计算（合金材料热传输、力学性质等）

Ø基于机器学习的光电材料的模拟技术开发和应用（用于材料介观尺度的分子动力学模拟研究）

Ø光电材料理论模拟与计算（微观聚集形貌、相分离的研究）

专利：

Ø刘建川; 孟令炜; 陆洲, 一种防激光测量中样品局部过热和挥发恒温池, No. CN 207336340 U

Ø刘建川; 贾国柱, 一种微波低温裂解生活垃圾加速反应方法, No. CN 105199754 A

论文：

1.     Liu, J.C; Liu, R.X.; Cao, Y.; Chen, M.H.; Solvation structure of Calcium and Magnesium ions in water with the presence of hydroxide: a study by deep potential molecular dynamics. Physical Chemistry Chemical Physics 2022. (SCI二区TOP, IF=3.945)

2.     Zheng, W. Y.; Liu, J.C; Guo, Y.; Han,G.C; Yi, Y.P.; Regulation of Molecular Orientations of A-D-A Non-Fullerene Acceptors for Organic Photovoltaics: The Role of End-Group π-π Stacking. Advanced Functional Materials2022. (SCI一区TOP, IF=19.924)

3.     Liu, J.C; Zheng, W.Y.; Han, G.C.; Yi, Y.P.;Molecular origin of carbon-oxygen-bridge isomerization induced reverse aggregation ability in A-D-A electron acceptors for organic solar cells. Solar RRL2021. (SCI一区TOP, IF=9.173)

4.     Liu, J.C; Li, X.; Hou, J.; Liu, F., Electric-Field-Induced Interface Behavior of Dodecyl Sulfate with Large Organic Counterions: A Molecular Dynamics Study. The journal of physical chemistry B 2020. (SCI二区, IF=3.446)

5.     Liu, J.C; Li, X.; Hou, J.; Li, X.; Lu, Z., The Influence of Sodium Iodide Salt on Interfacial Properties of Aqueous Methanol Solution by a Combined Molecular Simulation and Sum Frequency Generation Vibrational Spectroscopy Study. Langmuir 2019. (SCI二区TOP, IF=4.331)

6.     Li, X^#.; Liu, J.C^#; Lin, K.; Zhang, Y.; Zhang, Y.; Zheng, R.; Shi, Q.; Guo, Y.; Lu, Z., Toward Unraveling the Puzzle of Sum Frequency Generation Spectra at Interface of Aqueous Methanol Solution: Effects of Concentration-Dependent Hyperpolarizability. The Journal of Physical Chemistry C 2019. (共同一作，SCI二区TOP, IF=4.177)

7.     Liu, J.C; Jia, G.; Lu, Z., Dielectric Properties of Pyridine Derivative-Water Clusters: Molecular Dynamics Simulation. Journal of Molecular Liquids 2017. (SCI二区, IF=6.633)

8.     Liu, J.C; Jia, G., Non-Thermal Effects of Microwave in Sodium Chloride Aqueous Solution: Insights from Molecular Dynamics Simulations. Journal of Molecular Liquids 2017. (SCI二区, IF=6.633)

9.     Liu, J.C;Jia, G., Reconsideration of Dielectric Relaxation of Aqueous Urea Solutions at Different Temperatures. Journal of Solution Chemistry 2016. (SCI四区, IF=2.000)

10.   Liu, J.C; Jia, G.; Liu, S., Dielectric Relaxation in Isobutyl Alcohol-Nmp and Isobutyl Alcohol-Dmso Mixtures Studied by Microwave Dielectric Relaxation Spectroscopy. Colloid and Polymer Science 2015. (SCI三区, IF=2.434)

11.   Liu, J.C; Jia, G.; Liu, F., Dielectric Properties of Pyridine N-Oxide Aqueous Solution under the Static Electric Field and Microwave Field. Molecular Physics 2015. (SCI三区, IF=1.973)

12.   Liu, J.C; Jia, G., Dielectric Relaxation of 1-Methylimidazole-Ethanol Mixtures at the Microwave Frequency. Colloid and Polymer Science 2015. (SCI三区, IF=2.434)

13.   Jia, G.; Liu, J.C; Yang, X., The Hydrogen Bonding Analysis of 1-Methylimidazole–Water Mixtures Studied by Dielectric Relaxation Spectroscopy. Fluid Phase Equilibria 2014. (SCI三区, IF=2.745)

Ø 2018年度中科院青年科学奖  

Ø第十届全国大学生电子商务挑战赛四川赛区一等奖（指导教师）