孫兆茹

時間:2018-09-11浏覽:4693設置

孫兆茹课题组介绍


課題組長
孫兆茹,助理教授、研究員
通訊地址:
電子郵件:sunzhr@@shanghaitech.edu.cn
2005.9-2009.7,山東大學物理學院,本科
2009.9-2014.7,北京大學物理學院量子材料科學中心,博士
2014.11-2018.7,美國天普大學,博士後
2018.9-至今,大盛平台物质学院,助理教授、研究員

研究介紹
1. 水科学:体态水、受限水的结构和动力学;水在表面的吸附
2. 氢键材料X射线吸收谱、激发谱的模拟
3. 分子动力学(经验势、第一性原理、路径积分)、GW方法计算电子激发态

發表文章



Zhaoru Sun, Lixin Zheng, Mohan Chen, Michael L. Klein, Francesco Paesani, Xifan Wu. “Electron-hole theory of the effect of quantum nuclei on the X-ray absorption spectra of liquid water” Accepted by Phys. Rev. Lett.

Lixin Zheng, Mohan Chen, Zhaoru Sun, Hsin-Yu Ko, Biswajit Santra, Pratikkumar Dhuvad, Xifan Wu. “Structural, electronic, and dynamical properties of liquid water by ab initio molecular dynamics based on SCAN functional within the canonical ensemble” J. Chem. Phys. 148, 164505 (2018).

Huaze Shen, Mohan Chen, Zhaoru Sun, Limei Xu, Xifan Wu. “Signature of hydrogen-bonded environment of liquid water in X-ray emission spectra by first-principles calculations” Front. Phys. 13, 138204 (2018).

Zhaoru Sun, Mohan Chen, Lixin Zheng, Jianping Wang, Biswajit Santra, Huaze Shen, Limei Xu, Wei Kang, Michael L. Klein, Xifan Wu. “X-ray absorption of liquid water by advanced ab initio methods” Phys. Rev. B 96, 104202 (2017).

Jianwei Sun, Richard C. Remsing, Yubo Zhang, Zhaoru Sun, Adrienn Ruzsinszky, Haowei Peng, Zenghui Yang, Arpita Paul, Umesh Waghmare, Xifan Wu, Michael L. Klein, John P. Perdew. “Accurate firstprinciples structures and energies of diversely bonded systems from an efficient density functional” Nature Chemistry, 8, 831 (2016).

Zhaoru Sun, Gang Sun, Yixuan Chen, Limei Xu. “Liquid-liquid phase transition in water” Invited review on SCIENCE CHINA Physics, Mechanics & Astronomy. 5 (2014).

Meng Cheng, Duoming Wang, Zhaoru Sun (co-first author), Limei Xu, Enge Wang, Guangyu Zhang. “A Route towards digital Manipulation of Water Nanodroplets on Surface” ACS Nano, 8, 3955 (2014).

Zhaoru Sun, Ding Pan, Limei Xu, Enge Wang. “Role of proton ordering in adsorption preference of polar molecule on ice surface” Proc. Natl. Acad. Sci. 109, 13177 (2012).



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