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Emergent superconductivity in clathrate Sr(B,C)9 at low pressures Journal article
Zhang, Dandan, Bhullar, Mangladeep, Cui, Xiangyue, Zhang, Miao, Wang, Hui, Yao, Yansun. Emergent superconductivity in clathrate Sr(B,C)9 at low pressures[J]. Computational Materials Science, 2025, 246, 113419.
Authors:  Zhang, Dandan;  Bhullar, Mangladeep;  Cui, Xiangyue;  Zhang, Miao;  Wang, Hui; et al.
Favorite | TC[WOS]:0 TC[Scopus]:1  IF:3.1/3.2 | Submit date：2025/01/22
Boron-carbon Clathrates  Electronic Structure  First Principles  Mechanical Properties  Superconductivity  
Unraveling energetics and states of adsorbing oxygen species with MoS2 for modulated work function Journal article
Yan, Hejin, Chen, Hongfei, Cui, Xiangyue, Guan, Qiye, Wang, Bowen, Cai, Yongqing. Unraveling energetics and states of adsorbing oxygen species with MoS2 for modulated work function[J]. Nanoscale Horizons, 2024.
Authors:  Yan, Hejin;  Chen, Hongfei;  Cui, Xiangyue;  Guan, Qiye;  Wang, Bowen; et al.
Favorite | TC[WOS]:0 TC[Scopus]:0  IF:8.0/8.8 | Submit date：2024/12/05
Electronic structure of CsPbBr3 with isovalent doping and divacancies: the smallest metal Pb cluster Journal article
Cui, Xiangyue, Wang, Bowen, Zhang, Dandan, Chen, Hongfei, Yan, Hejin, Shu, Zheng, Cai, Yongqing. Electronic structure of CsPbBr3 with isovalent doping and divacancies: the smallest metal Pb cluster[J]. Journal of Materials Chemistry A, 2024, 13(3), 2227-2236.
Authors:  Cui, Xiangyue;  Wang, Bowen;  Zhang, Dandan;  Chen, Hongfei;  Yan, Hejin; et al.
Favorite | TC[WOS]:0 TC[Scopus]:0  IF:10.7/10.8 | Submit date：2024/12/26
压力下超导 RbBSi 化合物的预测 Journal article
Liu, Jinyu, Cui, Xiangyue, Liu, Ailing, Cheng, Xiaoran, Wang, Xingyu, Wang, Yujia, Zhang, Miao. 压力下超导 RbBSi 化合物的预测[J]. Gaoya Wuli Xuebao/Chinese Journal of High Pressure Physics, 2024, 38(2), 020107.
Authors:  Liu, Jinyu;  Cui, Xiangyue;  Liu, Ailing;  Cheng, Xiaoran;  Wang, Xingyu; et al.
Favorite | TC[Scopus]:0 | Submit date：2024/06/05
Alkali-metal Boron-silicide  Crystal Structure Prediction  First-principles Calculations  High-pressure  
Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications Journal article
Cui, Xiangyue, Cai, Yongqing. Computational Study of Strong Phonon Softening and Electron-Phonon Interaction in Doped Monolayer Tellurene: Implications for Neuromorphic Applications[J]. ACS Applied Nano Materials, 2023, 6(19), 17457-17463.
Authors:  Cui, Xiangyue;  Cai, Yongqing
Favorite | TC[WOS]:2 TC[Scopus]:2  IF:5.3/5.4 | Submit date：2024/01/10
2d Tellurene  Charge Doping  Electron−phonon Interaction  First-principles Calculation  Lattice Vibration  
Promoted Electronic Coupling of Acoustic Phonon Modes in Doped Semimetallic MoTe2 Journal article
Cui, Xiangyue, Yan, Hejin, Yan, Xuefei, Zhou, Kun, Cai, Yongqing. Promoted Electronic Coupling of Acoustic Phonon Modes in Doped Semimetallic MoTe2[J]. ACS Nano, 2023, 17(17), 16530-16538.
Authors:  Cui, Xiangyue;  Yan, Hejin;  Yan, Xuefei;  Zhou, Kun;  Cai, Yongqing
Favorite | TC[WOS]:3 TC[Scopus]:2  IF:15.8/16.2 | Submit date：2024/01/10
Charge Doping  Electron−phonon Coupling  First-principles Calculation  Molybdenum Ditelluride  Superconductivity  Two-dimensional Materials  
Exploration of AB3Si3 (A = Na/K/Rb/Cs) compounds under moderate pressure Journal article
Cui, Xiangyue, Zhang, Miao, Gao, Lili. Exploration of AB3Si3 (A = Na/K/Rb/Cs) compounds under moderate pressure[J]. Physical Chemistry Chemical Physics, 2023, 25(35), 23847-23854.
Authors:  Cui, Xiangyue;  Zhang, Miao;  Gao, Lili
Favorite | TC[WOS]:2 TC[Scopus]:3  IF:2.9/3.0 | Submit date：2024/01/10
Surface asymmetry induced turn-overed lifetime of acoustic phonons in monolayer MoSSe Journal article
Yan, Xuefei, Cui, Xiangyue, Wang, Bowen, Yan, Hejin, Cai, Yongqing, Ke, Qingqing. Surface asymmetry induced turn-overed lifetime of acoustic phonons in monolayer MoSSe[J]. iScience, 2023, 26(5), 106731.
Authors:  Yan, Xuefei;  Cui, Xiangyue;  Wang, Bowen;  Yan, Hejin;  Cai, Yongqing; et al.
Favorite | TC[WOS]:6 TC[Scopus]:6  IF:4.6/5.0 | Submit date：2023/06/05
Acoustic Property  Materials Property  Physics  
High-performance thermoelectric monolayer γ-GeSe and its group-IV monochalcogenide isostructural family Journal article
Shu, Zheng, Wang, Bowen, Cui, Xiangyue, Yan, Xuefei, Yan, Hejin, Jia, Huaxian, Cai, Yongqing. High-performance thermoelectric monolayer γ-GeSe and its group-IV monochalcogenide isostructural family[J]. Chemical Engineering Journal, 2023, 454, 140242.
Authors:  Shu, Zheng;  Wang, Bowen;  Cui, Xiangyue;  Yan, Xuefei;  Yan, Hejin; et al.
Favorite | TC[WOS]:42 TC[Scopus]:41  IF:13.3/13.2 | Submit date：2023/02/22
Additive Molecules Adsorbed on Monolayer PbI2: Atomic Mechanism of Solvent Engineering for Perovskite Solar Cells Journal article
Chen,Hongfei, Guan,Qiye, Yan,Hejin, Cui,Xiangyue, Shu,Zheng, Cai,Yongqing. Additive Molecules Adsorbed on Monolayer PbI2: Atomic Mechanism of Solvent Engineering for Perovskite Solar Cells[J]. ACS Applied Materials and Interfaces, 2023, 15(27), 32475-32486.
Authors:  Chen,Hongfei;  Guan,Qiye;  Yan,Hejin;  Cui,Xiangyue;  Shu,Zheng; et al.
Favorite | TC[WOS]:12 TC[Scopus]:12  IF:8.3/8.7 | Submit date：2023/08/03
Defect Passivation  Ionic Liquids  Lewis Base  Perovskite Precursor  Solvents Engineering