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Keyword: first-principles calculation
Research Article
Vibrational properties of silicene and germanene
Emilio Scalise, Michel Houssa, Geoffrey Pourtois, [...], B. van den Broek, Valery Afanas'ev, André Stesmans << Fewer
Published: 17 December 2012
2013, 6 (1): 19-28
Research Article
Hexagonal FeS nanosheets with high-energy (001) facets: Counter electrode materials superior to platinum for dye-sensitized solar cells
Xiuwen Wang, Ying Xie, Buhe Bateer, [...], Kai Pan, Yangtao Zhou, Yi Zhang, Guofeng Wang, Wei Zhou, Honggang Fu << Fewer
Published: 08 July 2016
2016, 9 (10): 2862-2874
Research Article
gt-C3N4 coordinated single atom as an efficient electrocatalyst for nitrogen reduction reaction
Lifu Zhang, Wanghui Zhao, Wenhua Zhang, [...], Jing Chen, Zhenpeng Hu << Fewer
Published: 29 March 2019
2019, 12 (5): 1181-1186
Research Article
The study of the interactions between graphene and Ge(001)/Si(001)
Pawel Dabrowski, Maciej Rogala, Iwona Pasternak, [...], Jacek Baranowski, Wlodzimierz Strupinski, Marek Kopciuszynski, Ryszard Zdyb, Mieczyslaw Jalochowski, Iaroslav Lutsyk, Zbigniew Klusek << Fewer
Published: 06 May 2017
2017, 10 (11): 3648-3661
Research Article
Enhancing electrocatalytic N2-to-NH3 fixation by suppressing hydrogen evolution with alkylthiols modified Fe3P nanoarrays
Tong Xu, Jie Liang, Yuanyuan Wang, [...], Shaoxiong Li, Zhaobai Du, Tingshuai Li, Qian Liu, Yonglan Luo, Fang Zhang, Xifeng Shi, Bo Tang, Qingquan Kong, Abdullah M. Asiri, Chun Yang, Dongwei Ma, Xuping Sun << Fewer
Published: 01 July 2021
2022, 15 (2): 1039-1046
Research Article
Flexible highly-effective energy harvester via crystallographic and computational control of nanointerfacial morphotropic piezoelectric thin film
Chang Kyu Jeong, Sung Beom Cho, Jae Hyun Han, [...], Dae Yong Park, Suyoung Yang, Kwi-Il Park, Jungho Ryu, Hoon Sohn, Yong-Chae Chung, Keon Jae Lee << Fewer
Published: 02 November 2016
2017, 10 (2): 437-455
Research Article
Theoretical kinetic quantitative calculation predicted the expedited polysulfides degradation
Siyu Zhang, Xianchao Rong, Tao Li, [...], Wenjie Ren, Hao Ren, Linjie Zhi, Mingbo Wu, Zhongtao Li << Fewer
Published: 12 November 2022
2023, 16 (10): 12035-12042
Research Article
A two-dimensional tetragonal structure of vanadium telluride
Zizhao Liu, Ye Tao, Zhiqiang Cui, [...], Yi Ji, Xuhan Zhou, Peigen Li, Yunwei Zhang, Dingyong Zhong << Fewer
Published: 09 March 2023
2023, 16 (5): 7749-7755
Research Article
Invisible vapor catalysis in graphene growth by chemical vapor deposition
Xiucai Sun, Xiaoting Liu, Zhongti Sun, [...], Xintong Zhang, Yuzhu Wu, Yeshu Zhu, Yuqing Song, Kaicheng Jia, Jincan Zhang, Luzhao Sun, Wan-Jian Yin, Zhongfan Liu << Fewer
Published: 01 December 2023
2024, 17 (5): 4259-4269
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