Publications by authors named "Jinyang Xi"

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Momentum-Direct Infrared Interlayer Exciton and Photodetection in Multilayer van der Waals Heterostructures.
Chao Zhang, Kai Wu, Lu Gan, Xiaoyi Liu, Cheng Zhang, Xiaoming Yuan, Jinyang Xi, Xiaofeng Li

ACS Nano· December 2024

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First-principles study of the temperature-induced band renormalization in thermoelectric filled skutterudites.
Jinyan Ning, Wenxin Lei, Jiong Yang, Jinyang Xi

Phys Chem Chem Phys· October 2023

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Atomistic Insights into the Origin of High-Performance Thermoelectric Response in Hybrid Perovskites.
Wen Shi, Mingjia Yao, Xiaomei Wu, Tingxia Zhou, Xue Yong, Jinyang Xi

Adv Sci (Weinh)· July 2023

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Decomposition of Al promoted by salicylic acid under acidic condition: Mechanism study by differential mass spectrometry method and DFT calculation.
Guangyu An, Ye Yue, Lian Yang, Hailu Demissie, Ruyuan Jiao, Jinyang Xi

J Environ Sci (China)· April 2023

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A Critical Review of Machine Learning Techniques on Thermoelectric Materials.
Xiangdong Wang, Ye Sheng, Jinyan Ning, Jinyang Xi, Lili Xi

J Phys Chem Lett· February 2023

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Functional-Unit-Based Material Design: Ultralow Thermal Conductivity in Thermoelectrics with Linear Triatomic Resonant Bonds.
Jialin Ji, Qinghang Tang, Mingjia Yao, Hongliang Yang, Yeqing Jin, Jinyang Xi

J Am Chem Soc· October 2022

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Temperature-dependence of the band gap in the all-inorganic perovskite CsPbI from room to high temperatures.
Jinyan Ning, Liangliang Zheng, Wenxin Lei, Shenghao Wang, Jinyang Xi

Phys Chem Chem Phys· July 2022

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Temperature-dependent structural fluctuation and its effect on the electronic structure and charge transport in hybrid perovskite CH NH PbI.
Jinyang Xi, Liangliang Zheng, Shenghao Wang, Jiong Yang, Wenqing Zhang

J Comput Chem· December 2021

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Temperature-dependent band gaps in several semiconductors: from the role of electron-phonon renormalization.
Yiming Zhang, Ziyu Wang, Jinyang Xi, Jiong Yang

J Phys Condens Matter· August 2020

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An accurate single descriptor for ion-π interactions.
Zhangyun Liu, Zheng Chen, Jinyang Xi, Xin Xu

Natl Sci Rev· June 2020

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Achieving band convergence by tuning the bonding ionicity in n-type Mg Sb.
Xin Sun, Xin Li, Jiong Yang, Jinyang Xi, Ryky Nelson

J Comput Chem· July 2019

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The origin of intrinsic charge transport for Dirac carbon sheet materials: roles of acetylenic linkage and electron-phonon couplings.
Changdong Liu, Jiong Yang, Jinyang Xi, Xuezhi Ke

Nanoscale· June 2019

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Discovery of High-Performance Thermoelectric Chalcogenides through Reliable High-Throughput Material Screening.
Lili Xi, Shanshan Pan, Xin Li, Yonglin Xu, Jianyue Ni, Xin Sun, Jinyang Xi, Xinran Li

J Am Chem Soc· August 2018

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Erratum: Intrinsic and Extrinsic Charge Transport in CHNHPbI Perovskites Predicted from First-Principles.
Tianqi Zhao, Wen Shi, Jinyang Xi, Dong Wang, Zhigang Shuai

Sci Rep· April 2017

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Understanding the anion-π interactions with tetraoxacalix[2]arene[2]triazine.
Jinyang Xi, Xin Xu

Phys Chem Chem Phys· March 2016

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Intrinsic and Extrinsic Charge Transport in CH3NH3PbI3 Perovskites Predicted from First-Principles.
Tianqi Zhao, Wen Shi, Jinyang Xi, Dong Wang, Zhigang Shuai

Sci Rep· January 2016

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Unravelling Doping Effects on PEDOT at the Molecular Level: From Geometry to Thermoelectric Transport Properties.
Wen Shi, Tianqi Zhao, Jinyang Xi, Dong Wang, Zhigang Shuai

J Am Chem Soc· October 2015

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Theoretical comparative studies on transport properties of pentacene, pentathienoacene, and 6,13-dichloropentacene.
Xu Zhang, Xiaodi Yang, Hua Geng, Guangjun Nan, Xingwen Sun, Jinyang Xi, Xin Xu

J Comput Chem· May 2015

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Electron-phonon couplings and carrier mobility in graphynes sheet calculated using the Wannier-interpolation approach.
Jinyang Xi, Dong Wang, Yuanping Yi, Zhigang Shuai

J Chem Phys· July 2014

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Interface electronic structures of reversible double-docking self-assembled monolayers on an Au(111) surface.
Tian Zhang, Zhongyun Ma, Linjun Wang, Jinyang Xi, Zhigang Shuai

Philos Trans A Math Phys Eng Sci· April 2014

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Tunable Electronic Properties of Two-Dimensional Transition Metal Dichalcogenide Alloys: A First-Principles Prediction.
Jinyang Xi, Tianqi Zhao, Dong Wang, Zhigang Shuai

J Phys Chem Lett· January 2014

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Tunable band gap photoluminescence from atomically thin transition-metal dichalcogenide alloys.
Yanfeng Chen, Jinyang Xi, Dumitru O Dumcenco, Zheng Liu, Kazu Suenaga, Liming Xie

ACS Nano· May 2013

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Carrier Mobility in Graphyne Should Be Even Larger than That in Graphene: A Theoretical Prediction.
Jianming Chen, Jinyang Xi, Dong Wang, Zhigang Shuai

J Phys Chem Lett· May 2013

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Modeling thermoelectric transport in organic materials.
Dong Wang, Wen Shi, Jianming Chen, Jinyang Xi, Zhigang Shuai

Phys Chem Chem Phys· December 2012

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First-principles prediction of charge mobility in carbon and organic nanomaterials.
Jinyang Xi, Mengqiu Long, Ling Tang, Dong Wang, Zhigang Shuai

Nanoscale· August 2012

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