Publications: 2021

PUBLICATIONS

2021

Note:

1. *denotes equal contribution, #denotes corresponding author

2. PDF files of the publications can be accessed here. All of the files are copyrighted. You may download them only if you are entitled to do so by your arrangements with individual publishers.

1. "Comparing data driven and physics inspired models for hopping transport in organic field effect transistors", Scientific Reports, 11, 23621, 2021. (Link)

Madhavkrishnan Lakshminarayanan, Rajdeep Dutta, D. V. Maheswar Repaka, Senthilnath Jayavelu#, Wei Lin Leong# & Kedar Hippalgaonkar#

2. "Benchmarking the performance of Bayesian optimization across multiple experimental materials science domains", npj Computational Material, 7, 188, 2021. (Link)

Qiaohao Liang, Aldair E. Gongora, Zekun Ren, Armi Tiihonen, Zhe Liu, Shijing Sun, James R. Deneault, Daniil Bash, Flore Mekki-Berrada, Saif A. Khan, Kedar Hippalgaonkar, Benji Maruyama, Keith A. Brown, John Fisher III, Tonio Buonassisi

3. "High Thermoelectric Performance through Crystal Symmetry Enhancement in Triply Doped Diamondoid Compound Cu2SnSe3", Advanced Energy Materials, 11, 42, 2100661, 2021. (Link)

Lei Hu, Yubo Luo, Yue-Wen Fang, Feiyu Qin, Xun Cao, Hongyao Xie, Jiawei Liu, Jinfeng Dong, Andrea Sanson, Marco Giarola, Xianyi Tan, Yun Zheng, Ady Suwardi, Yizhong Huang, Kedar Hippalgaonkar, Jiaqing He, Wenqing Zhang, Jianwei Xu, Qingyu Yan#, and Mercouri G. Kanatzidis#

4. "Extrapolative Bayesian Optimization with Gaussian Process and Neural Network Ensemble Surrogate Models", Advanced Intelligent Systems, 2100101, 2021. (Link)

Yee-Fun Lim#, Chee Koon Ng, US Vaitesswar, Kedar Hippalgaonkar#

5. "Materials Horizons Emerging Investigator Series: Professor Kedar Hippalgaonkar, Nanyang Technological University, Singapore", Materials Horizons, 8, 2357-2358, 2021. (Link)

6. "Multi‐Fidelity High‐Throughput Optimization of Electrical Conductivity in P3HT‐CNT Composites", Advanced Functional Materials, 31, 36, 2102606, 2021. (Link)

Daniil Bash, Yongqiang Cai, Vijila Chellappan, Swee Liang Wong, Xu Yang, Pawan Kumar, Jin Da Tan, Anas Abutaha, Jayce JW Cheng, Yee‐Fun Lim, Siyu Isaac Parker Tian, Zekun Ren, Flore Mekki‐Berrada, Wai Kuan Wong, Jiaxun Xie, Jatin Kumar, Saif A Khan, Qianxiao Li#, Tonio Buonassisi#, Kedar Hippalgaonkar#

7. "Interpretable physics-based models compared with symbolic regression for hopping transport in organic field-effect transistors", NPJ Scientific Reports (Under Review), Preprint (Version 1) available at Research Square, 10 August 2021. (Link)

Madhavkrishnan Lakshminarayanan, Rajdeep Dutta, D V Maheswar Repaka, Senthilnath Jayavelu, Wei Lin Leong, Kedar Hippalgaonkar#

8. "High thermoelectric performance enabled by convergence of nested conduction bands in Pb7Bi4Se13 with low thermal conductivity", Nature Communications,12, 4793, 2021. (Link)

Lei Hu#, Yue-Wen Fang, Feiyu Qin, Xun Cao, Xiaoxu Zhao, Yubo Luo, Durga Venkata Maheswar Repaka, Wenbo Luo, Ady Suwardi, Thomas Soldi, Umut Aydemir, Yizhong Huang, Zheng Liu, Kedar Hippalgaonkar, G. Jeffrey Snyder, Jianwei Xu, Qingyu Yan#

9. "Metastable 1T′-phase group VIB transition metal dichalcogenide crystals", Nature Materials, 20, 1113–1120, 2021. (Link)

Zhuangchai Lai, Qiyuan He, Thu Ha Tran, DV Maheswar Repaka, Dong-Dong Zhou, Ying Sun, Shibo Xi, Yongxin Li, Apoorva Chaturvedi, Chaoliang Tan, Bo Chen, Gwang-Hyeon Nam, Bing Li, Chongyi Ling, Wei Zhai, Zhenyu Shi, Dianyi Hu, Vinay Sharma, Zhaoning Hu, Ye Chen, Zhicheng Zhang, Yifu Yu, Xiao Renshaw Wang, Raju V Ramanujan, Yanming Ma, Kedar Hippalgaonkar#, Hua Zhang#

10. "Two-step machine learning enables optimized nanoparticle synthesis", npj Computational Materials, 7, 55, 2021. (Link)

Flore Mekki-Berrada, Zekun Ren, Tan Huang, Wai Kuan Wong, Fang Zheng, Jiaxun Xie, Isaac Parker Siyu Tian, Senthilnath Jayavelu, Zackaria Mahfoud, Daniil Bash, Kedar Hippalgaonkar, Saif Khan, Tonio Buonassisi, Qianxiao Li, Xiaonan Wang#

11. "Efficacious symmetry-adapted atomic displacement method for lattice dynamical studies", Computer Physics Communications, 259, 107635, 2021. (Link)

Chee Kwan Gan#, Yun Liu, Tze Chien Sum, Kedar Hippalgaonkar

12. "Organic materials as photocatalysts for water splitting", Journal of Materials Chemistry A, 9, 16222, 2021. (Link)

Yang Bai, Kedar Hippalgaonkar, Reiner Sebastian Sprick

13. "Electronic transport descriptors for the rapid screening of thermoelectric materials", Materials Horizons, 8, 2463-2474, 2021. (Link)

Tianqi Deng, Jose Recatalà-Gómez, Masato Ohnishi, Repaka DV Maheswar, Pawan Kumar, Ady Suwardi, Anas Abutaha, Iris Nandhakumar, Kanishka Biswas, Michael Brian Sullivan, Gang Wu, Junichiro Shiomi#, Shuo-Wang Yang#, Kedar Hippalgaonkar#

14. "Gate‐Tunable Polar Optical Phonon to Piezoelectric Scattering in Few‐Layer Bi2O2Se for High‐Performance Thermoelectrics", 33, 4, 2004786, 2021. (Link)

Fang Yang, Jing Wu#, Ady Suwardi, Yunshan Zhao, Boyuan Liang, Jie Jiang, Jianwei Xu, Dongzhi Chi, Kedar Hippalgaonkar, Junpeng Lu#, Zhenhua Ni#