- 所在梯隊(duì):計(jì)算物理梯隊(duì)
- 辦公地點(diǎn):理學(xué)樓113
- 本科生課程:固體物理 原子物理 大學(xué)物理 文科物理 材料高通量計(jì)算原理與設(shè)計(jì)(材料高精尖班)
- 研究生課程:材料基因系列課程之一《計(jì)算材料學(xué)》
教育經(jīng)歷
1987.9——1991.7 河南大學(xué)物理系就讀本科 獲學(xué)士學(xué)位
2001.9——2005.6 永利集團(tuán)3044am官方入口碩博連讀 獲博士學(xué)位
2012.9——2013.9在加拿大McGill University 高級(jí)訪問(wèn)學(xué)者
工作經(jīng)歷
主講課程:
力學(xué)、熱學(xué)、光學(xué)、電磁學(xué)、磁性材料與器件、大學(xué)物理和凝聚態(tài)物理發(fā)展前沿。
科研項(xiàng)目:
國(guó)家自然科學(xué)基金項(xiàng)目“釷金屬間化合物結(jié)構(gòu)性質(zhì)的研究”,項(xiàng)目編號(hào):50971024。項(xiàng)目負(fù)責(zé)人。
國(guó)家重點(diǎn)基礎(chǔ)研究發(fā)展規(guī)劃(973)項(xiàng)目“材料計(jì)算設(shè)計(jì)與性能預(yù)測(cè)基礎(chǔ)問(wèn)題”中的子課題:“新型稀土化合物結(jié)構(gòu)設(shè)計(jì)(TG2000067106)”課題,項(xiàng)目主要骨干成員。
國(guó)家重點(diǎn)基礎(chǔ)研究發(fā)展計(jì)劃(973計(jì)劃)項(xiàng)目:“面向性能的材料集成設(shè)計(jì)的科學(xué)基礎(chǔ)問(wèn)題”/課題名稱:材料原子勢(shì)庫(kù)創(chuàng)新服務(wù)系統(tǒng)/課題編號(hào):2006CB605101的研究。項(xiàng)目主要骨干成員。
科研業(yè)績(jī)
Scientific research achievements
1. The National Key Research and Development Program of China: Uncertainty quantization of atomic potential function for material base database extension (Grant No. 2016YFB0700500)
2. The National Key Research and Development Program of China: Big data processing technology for high throughput material calculation (Grant No.2018YFB0704300)
3. The National Key Research and Development Program of China: Data driven intelligent development and application of new high-performance functional materials (Grant No.2021YFB3802104)
Enrollment plan
One PhD student and two Master students per year
Representative papers
1. Wang Y, Fan Z, Qian P, Ala-Nissila T, Caro M. Structure and Pore Size Distribution in Nanoporous Carbon. CHEMISTRY OF MATERIALS 2022, 34(2). 617-628.
2. Wang C. X., Wang X. X., Zhang T. Y., Qian P., Lookman T., Su Y. J. A descriptor for the design of 2D MXene hydrogen evolution reaction electrocatalysts. JOURNAL OF MATERIALS CHEMISTRY A 2022. DOI: 10.1039/D2TA02837A.
3. Dong H, Xiong S, Fan Z, Qian P, Su Y, Ala-Nissila T. Interpretation of apparent thermal conductivity in finite systems from equilibrium molecular dynamics simulations. PHYS REV B 2021, 103(3).
4. Wang X, Wang C, Ci S, Ma Y, Liu T, Gao L, Qian P, Ji C, Su Y. Accelerating 2D MXene catalyst discovery for the hydrogen evolution reaction by computer-driven workflow and an ensemble learning strategy. J MATER CHEM A 2020, 8(44): 23488-23497
5. Su Y, Cao S, Shi L, Qian P. Investigation of strain behavior and carrier mobility of organic-inorganic hybrid perovskites: (C4H9NH3)2GeI4 and (C4H9NH3)2SnI4. NANOSCALE 2020, 12(44): 22551-22563.
6. Dong H, Fan Z, Qian P, Ala-Nissila T, Su Y. Thermal conductivity reduction in carbon nanotube by fullerene encapsulation: A molecular dynamics study. CARBON 2020, 161: 800-808.
7. Li L, Wang Y, Wang X, Song K, Jian X, Qian P, Bai Y, Su Y. Size and Stoichiometry Effect of FePt Bimetal Nanoparticle Catalyst for CO Oxidation: A DFT Study. The Journal of Physical Chemistry C 2020, 124(16): 8706-8715.
8. Dong H, Fan Z, Qian P, Ala-Nissila T, Su Y. Thermal Conductivity Reduction in Carbon Nanotube by Fullerene Encapsulation: A Molecular Dynamics Study. CARBON 2020, 161: 800-808.
獲得獎(jiǎng)勵(lì)
獲獎(jiǎng)專利鑒定:博士畢業(yè)論文獲永利集團(tuán)3044am官方入口優(yōu)秀畢業(yè)論文獎(jiǎng)2014年6月在 永利集團(tuán)3044am官方入口第十五屆“我愛(ài)我?guī)?我心目中最優(yōu)秀的教師”評(píng)選活動(dòng)中榮獲“公共課優(yōu)秀老師”(大學(xué)物理課)