Enhanced Strength Through Nanotwinning in the Thermoelectric Semiconductor InSb
Li, Guodong, Morozov, Sergey I, Zhang, Qingjie, An, Qi, Zhai, Pengcheng, Snyder, G Jeffrey
Published in Physical review letters (24.11.2017)
Published in Physical review letters (24.11.2017)
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Design of a Graphene Nitrene Two-Dimensional Catalyst Heterostructure Providing a Well-Defined Site Accommodating One to Three Metals, with Application to CO2 Reduction Electrocatalysis for the Two-Metal Case
Chen, Shiqian, Yuan, Hao, Morozov, Sergey I, Ge, Lei, Li, Li, Xu, Lai
Published in The journal of physical chemistry letters (02.04.2020)
Published in The journal of physical chemistry letters (02.04.2020)
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Journal Article
Fracture toughness of thermoelectric materials
Li, Guodong, An, Qi, Duan, Bo, Borgsmiller, Leah, Malki, Muath Al, Agne, Matthias, Aydemir, Umut, Zhai, Pengcheng, Zhang, Qingjie, Morozov, Sergey I., Goddard, William A., Snyder, G. Jeffrey
Published in Materials science & engineering. R, Reports : a review journal (01.04.2021)
Published in Materials science & engineering. R, Reports : a review journal (01.04.2021)
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Journal Article
Deformation and Failure Mechanisms of Thermoelectric Type‑I Clathrate Ba8Au6Ge40
Zhang, Xiaolian, Zhai, Pengcheng, Huang, Xiege, Morozov, Sergey I, Duan, Bo, Li, Wenjuan, Chen, Gang, Li, Guodong, Goddard, William A
Published in ACS applied materials & interfaces (26.01.2022)
Published in ACS applied materials & interfaces (26.01.2022)
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Journal Article
Deformation and Failure Mechanisms of Thermoelectric Type-I Clathrate Ba 8 Au 6 Ge 40
Zhang, Xiaolian, Zhai, Pengcheng, Huang, Xiege, Morozov, Sergey I, Duan, Bo, Li, Wenjuan, Chen, Gang, Li, Guodong, Goddard, 3rd, William A
Published in ACS applied materials & interfaces (26.01.2022)
Published in ACS applied materials & interfaces (26.01.2022)
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Journal Article
High-Energy-Density Material with Magnetically Modulated Ignition
Allen, James E., Zybin, Sergey V., Morozov, Sergey I., O’Sullivan, Owen T., Kawamura, Colton, Waxler, David E., Hooper, Joseph P., Goddard III, William A., Zdilla, Michael J.
Published in Journal of the American Chemical Society (21.02.2024)
Published in Journal of the American Chemical Society (21.02.2024)
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Reaction Mechanism and Energetics of Decomposition of Tetrakis(1,3-dimethyltetrazol-5-imidoperchloratomanganese(II)) from Quantum-Mechanics-based Reactive Dynamics
Zybin, Sergey V, Morozov, Sergey I, Prakash, Prabhat, Zdilla, Michael J
Published in Journal of the American Chemical Society (20.10.2021)
Published in Journal of the American Chemical Society (20.10.2021)
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Journal Article
Dramatically reduced lattice thermal conductivity of Mg2Si thermoelectric material from nanotwinning
Li, Guodong, He, Jiangang, An, Qi, Morozov, Sergey I., Hao, Shiqiang, Zhai, Pengcheng, Zhang, Qingjie, Goddard, William A., Snyder, G. Jeffrey
Published in Acta materialia (01.05.2019)
Published in Acta materialia (01.05.2019)
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Journal Article
Ductile deformation mechanism in semiconductor α-Ag2S
Li, Guodong, An, Qi, Morozov, Sergey I., Duan, Bo, Goddard, William A., Zhang, Qingjie, Zhai, Pengcheng, Snyder, G. Jeffrey
Published in npj computational materials (13.08.2018)
Published in npj computational materials (13.08.2018)
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Journal Article
Mechanical softening of thermoelectric semiconductor Mg2Si from nanotwinning
Li, Guodong, An, Qi, Morozov, Sergey I., Duan, Bo, Goddard, William A., Zhai, Pengcheng, Zhang, Qingjie, Jeffrey Snyder, G.
Published in Scripta materialia (01.12.2018)
Published in Scripta materialia (01.12.2018)
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Journal Article
Design of a Graphene Nitrene Two-Dimensional Catalyst Heterostructure Providing a Well-Defined Site Accommodating One to Three Metals, with Application to CO 2 Reduction Electrocatalysis for the Two-Metal Case
Chen, Shiqian, Yuan, Hao, Morozov, Sergey I, Ge, Lei, Li, Li, Xu, Lai, Goddard, 3rd, William A
Published in The journal of physical chemistry letters (02.04.2020)
Published in The journal of physical chemistry letters (02.04.2020)
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Journal Article
Grain Boundaries Softening Thermoelectric Oxide BiCuSeO
Li, Guodong, Hao, Shiqiang, Morozov, Sergey I., Zhai, Pengcheng, Zhang, Qingjie, Goddard, William A., Snyder, G. Jeffrey
Published in ACS applied materials & interfaces (21.02.2018)
Published in ACS applied materials & interfaces (21.02.2018)
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Journal Article
Determining ideal strength and failure mechanism of thermoelectric CuInTe2 through quantum mechanics
Li, Guodong, An, Qi, Morozov, Sergey I, Duan, Bo, Zhai, Pengcheng, Zhang, Qingjie, Goddard, William A, Snyder, G Jeffrey
Published in Journal of materials chemistry. A, Materials for energy and sustainability (2018)
Published in Journal of materials chemistry. A, Materials for energy and sustainability (2018)
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Journal Article
The Mechanism of Deformation and Failure of In4Se3 Based Thermoelectric Materials
Deng, Wenying, Li, Guodong, Zhang, Xiaolian, Morozov, Sergey I, Goddard, William A, Zhai, Pengcheng
Published in ACS applied energy materials (27.01.2020)
Published in ACS applied energy materials (27.01.2020)
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Journal Article
Estimating the lower-limit of fracture toughness from ideal-strength calculations
Borgsmiller, Leah, Agne, Matthias T, Male, James P, Anand, Shashwat, Li, Guodong, Morozov, Sergey I, Snyder, G. Jeffrey
Published in Materials horizons (07.02.2022)
Published in Materials horizons (07.02.2022)
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