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Publication date Communities Collections Article title Author(s) Journal/Conference
5 Feb 2021 SERC Institute of High Performance Computing Ab initio dipolar electron-phonon interactions in two-dimensional materials Tianqi Deng, Gang Wu, Wen Shi, Zicong Marvin Wong, Jian-Sheng Wang, Shuo-Wang Yang Physical Review B
3 Dec 2020 SERC Institute of High Performance Computing Unravelling the Molecular Origin of Organic Semiconductors with High‐Performance Thermoelectric Response Wen Shi, Zicong Marvin Wong, Tianqi Deng, Gang Wu, Shuo‐Wang Yang Advanced Functional Materials
14 Oct 2020 SERC Institute of High Performance Computing Strain Effects on the n-Type Thermoelectric Performance of the Small-Molecule Organic Semiconductor 2-5-Difluoro-7,7,8,8-Tetracyanoquinodimethane Zicong Marvin Wong, Tianqi Deng, Wen Shi, Gang Wu, Shuo-Wang Yang ACS Applied Energy Materials
28 Sep 2020 SERC Institute of High Performance Computing Theoretical search for high-performance thermoelectric donor–acceptor copolymers, the role of super-exchange couplings Xue Yong, Gang Wu, Wen Shi, Zicong Marvin Wong, Tianqi Deng, Qiang Zhu, Xiaoping Yang, Jian-Sheng Wang, Jianwei Xu, Shuo-Wang Yang Journal of Materials Chemistry A
25 Jun 2020 SERC Institute of High Performance Computing High performance photocatalytic and thermoelectric two-dimensional asymmetrically ordered Janus-like MXene alloys Zicong Marvin Wong, Tianqi Deng, Wen Shi, Gang Wu, Teck Leong Tan, Shuo-Wang Yang Materials Advances
7 May 2020 SERC Institute of High Performance Computing EPIC STAR: a reliable and efficient approach for phonon- and impurity-limited charge transport calculations Tianqi Deng, Gang Wu, Michael B. Sullivan, Zicong Marvin Wong, Kedar Hippalgaonkar, Jian-Sheng Wang, Shuo-Wang Yang npj Computational Materials
5 May 2020 SERC Institute of High Performance Computing Effect of substituents in sulfoxides on the enhancement of thermoelectric properties of PEDOT:PSS: experimental and modelling evidence Qiang Zhu, Erol Yildirim, Xizu Wang, Aung Ko Ko Kyaw, Tao Tang, Xiang Yun Debbie Soo, Zicong Marvin Wong, Gang Wu, Shuo-Wang Yang, Jianwei Xu Molecular Systems Design & Engineering
28 Apr 2020 SERC Institute of High Performance Computing The Role of Electrostatic Interaction between Free Charge Carriers and Counterions in Thermoelectric Power Factor of Conducting Polymers: From Crystalline to Polycrystalline Domains Erol Yildirim, Gang Wu, Zicong Marvin Wong, Tianqi Deng, Wen Shi, Jian-Sheng Wang, Jianwei Xu, Shuo-Wang Yang Advanced Theory Simulations
11 Feb 2020 SERC Institute of High Performance Computing Beyond the Mahan–Sofo best thermoelectric strategy: high thermoelectric performance from directional π-conjugation in two-dimensional poly(tetrathienoanthracene) Tianqi Deng, Xue Yong, Wen Shi, Zicong Marvin Wong, Gang Wu, Hui Pan, Jian-Sheng Wang, Shuo-Wang Yang Journal of Materials Chemistry A