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Jingming Shi
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Predicting the thermodynamic stability of solids combining density functional theory and machine learning
J Schmidt, J Shi, P Borlido, L Chen, S Botti, MAL Marques
Chemistry of Materials 29 (12), 5090-5103, 2017
2932017
Route to high- superconductivity via -intercalated hydride perovskites
W Cui, T Bi, J Shi, Y Li, H Liu, E Zurek, RJ Hemley
Physical Review B 101 (13), 134504, 2020
1162020
Effect of covalent bonding on the superconducting critical temperature of the HS-Se system
B Liu, W Cui, J Shi, L Zhu, J Chen, S Lin, R Su, J Ma, K Yang, M Xu, J Hao, ...
Physical Review B 98 (17), 174101, 2018
762018
High-throughput search of ternary chalcogenides for p-type transparent electrodes
J Shi, TFT Cerqueira, W Cui, F Nogueira, S Botti, MAL Marques
Scientific reports 7 (1), 43179, 2017
682017
The intrinsic magnetism, quantum anomalous Hall effect and Curie temperature in 2D transition metal trihalides
J Sun, X Zhong, W Cui, J Shi, J Hao, M Xu, Y Li
Physical Chemistry Chemical Physics 22 (4), 2429-2436, 2020
512020
Formation of ammonia–helium compounds at high pressure
J Shi, W Cui, J Hao, M Xu, X Wang, Y Li
Nature Communications 11 (1), 3164, 2020
442020
Prediction and synthesis of a non-Zintl silicon clathrate
TFT Cerqueira, S Pailhes, R Debord, VM Giordano, R Viennois, J Shi, ...
Chemistry of Materials 28 (11), 3711-3717, 2016
212016
Nitrogen-hydrogen-oxygen ternary phase diagram: New phases at high pressure from structural prediction
J Shi, W Cui, S Botti, MAL Marques
Physical Review Materials 2 (2), 023604, 2018
202018
Hydrogen segregation and its roles in structural stability and metallization: silane under pressure
W Cui, J Shi, H Liu, Y Yao, H Wang, T Iitaka, Y Ma
Scientific reports 5 (1), 13039, 2015
192015
Computational design of novel hydrogen-rich YS–H compounds
J Chen, W Cui, J Shi, M Xu, J Hao, AP Durajski, Y Li
ACS omega 4 (10), 14317-14323, 2019
182019
Hidden porous boron nitride as a high-efficiency membrane for hydrogen purification
S Lin, M Xu, Z Qu, Y Liang, Y Li, W Cui, J Shi, Q Zeng, J Hao, Y Li
Physical Chemistry Chemical Physics 22 (39), 22778-22784, 2020
172020
Investigation of new phases in the Ba–Si phase diagram under high pressure using ab initio structural search
J Shi, W Cui, JA Flores-Livas, A San-Miguel, S Botti, MAL Marques
Physical Chemistry Chemical Physics 18 (11), 8108-8114, 2016
162016
Prediction of superhard B 2 N 3 with two-dimensional metallicity
S Lin, M Xu, J Hao, X Wang, M Wu, J Shi, W Cui, D Liu, W Lei, Y Li
Journal of Materials Chemistry C 7 (15), 4527-4532, 2019
142019
Pressure-stabilized superconducting electride
Q Wang, W Cui, K Gao, J Chen, T Gu, M Liu, J Hao, J Shi, Y Li
Physical Review B 106 (5), 054519, 2022
132022
Superconducting hydrogen tubes in hafnium hydrides at high pressure
K Gao, W Cui, J Chen, Q Wang, J Hao, J Shi, C Liu, S Botti, MAL Marques, ...
Physical Review B 104 (21), 214511, 2021
132021
Prediction of strain-induced phonon-mediated superconductivity in monolayer YS
Z Qu, S Lin, M Xu, J Hao, J Shi, W Cui, Y Li
Journal of Materials Chemistry C 7 (36), 11184-11190, 2019
112019
Halogen molecular modifications at high pressure: the case of iodine
J Shi, E Fonda, S Botti, MAL Marques, T Shinmei, T Irifune, AM Flank, ...
Physical Chemistry Chemical Physics 23 (5), 3321-3326, 2021
102021
Metal-element-incorporation induced superconducting hydrogen clathrate structure at high pressure
J Ma, J Kuang, W Cui, J Chen, K Gao, J Hao, J Shi, Y Li
Chinese Physics Letters 38 (2), 027401, 2021
82021
Superior carbon nanotube stability by molecular filling: a single-chirality study at extreme pressures
C Bousige, A Stolz, SD Silva-Santos, J Shi, W Cui, C Nie, MAL Marques, ...
Carbon 183, 884-892, 2021
72021
Helium incorporation induced direct-gap silicides
S Ding, J Shi, J Xie, W Cui, P Zhang, K Yang, J Hao, L Zhang, Y Li
npj Computational Materials 7 (1), 89, 2021
62021
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Articles 1–20