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Yuan, Xiaoze
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1

Machine Learning-Accelerated First-Principles Study of Atom..:

Qi, Changlin ; Zhou, Yuwei ; Yuan, Xiaoze...
Materials.  17 (2024)  8 - p. 1810 , 2024
Link: https://doi.org/10.3390/..
 
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2

Lattice Thermal Conductivity of Mg3(Bi,Sb)2 Nanocomposites:..:

Peng, Qing ; Yuan, Xiaoze ; Zhao, Shuai.
Nanomaterials.  13 (2023)  22 - p. 2938 , 2023
Link: https://doi.org/10.3390/..
 
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3

Modulation the reaction paths of oxygen removal by electron..:

Gong, Huiyong ; Yuan, Xiaoze ; Qing, Ming...
Applied Surface Science.  640 (2023)  - p. 158088 , 2023
Link: https://doi.org/10.1016/..
 
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4

Thermoelectric Properties of Mg3(Bi,Sb)2 under Finite Tempe..:

Peng, Qing ; Ma, Xinjie ; Yang, Xiaoyu..
Nanomaterials.  14 (2023)  1 - p. 84 , 2023
Link: https://doi.org/10.3390/..
 
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5

Water-Induced Structural Evolution of LaTMSi Ternary Interm..:

Sun, Yongfang ; Ma, Huan ; Jiao, Yueyue...
Chemistry of Materials.  , 2023
Link: https://doi.org/10.1021/..
 
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6

Active learning to overcome exponential-wall problem for ef..:

Yuan, Xiaoze ; Zhou, Yuwei ; Peng, Qing...
npj Computational Materials.  9 (2023)  1 - p. , 2023
Link: https://doi.org/10.1038/..
 
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7

Active-learning search for unitcell structures: A case stud..:

Peng, Qing ; Yuan, Xiaoze ; Zhao, Shuai...
Computational Materials Science.  226 (2023)  - p. 112260 , 2023
Link: https://doi.org/10.1016/..
 
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8

Initial stage of carbonization of iron during hydrocarbons ..:

Liu, Yubing ; Yuan, Xiaoze ; Lu, Kuan...
Physical Chemistry Chemical Physics.  25 (2023)  5 - p. 4313-4322 , 2023
Link: https://doi.org/10.1039/..
 
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9

Assessing Effects of van der Waals Corrections on Elasticit..:

Peng, Qing ; Ma, Xinjie ; Yang, Xiaoyu...
Materials.  16 (2023)  19 - p. 6482 , 2023
Link: https://doi.org/10.3390/..
 
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10

Site Preference-Driven Mn4+ Stabilization in Double Perovsk..:

Wang, Yufei ; Ding, Fan ; Wu, Jiayu...
Inorganic Chemistry.  61 (2022)  8 - p. 3631-3640 , 2022
Link: https://doi.org/10.1021/..
 
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11

Fe-Sn bimetallic catalysts for an enhanced Fischer-Tropsch ..:

Gong, Huiyong ; Qing, Ming ; Wan, Hongliu...
Fuel.  311 (2022)  - p. 122115 , 2022
Link: https://doi.org/10.1016/..
 
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12

Elasticity of Mg3Bi2-xSbx:

Peng, Qing ; Zhao, Shuai ; Yuan, Xiaoze.
Materials.  15 (2022)  20 - p. 7161 , 2022
Link: https://doi.org/10.3390/..
 
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13

Crystal Structure Prediction Approach to Explore the Iron C..:

Yuan, Xiaoze ; Zhou, Yuwei ; Huo, Chunfang...
The Journal of Physical Chemistry C.  124 (2020)  31 - p. 17244-17254 , 2020
Link: https://doi.org/10.1021/..
 
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14

Thermoelectric Properties of Mg 3 (Bi,Sb) 2 under Finite Te..:

Qing Peng ; Xinjie Ma ; Xiaoyu Yang..
https://www.mdpi.com/2079-4991/14/1/84.  , 2023
Link: https://doi.org/10.3390/..
 
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15

Assessing Effects of van der Waals Corrections on Elasticit..:

Qing Peng ; Xinjie Ma ; Xiaoyu Yang...
https://www.mdpi.com/1996-1944/16/19/6482.  , 2023
Link: https://doi.org/10.3390/..
 
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