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科研机构

厦门大学 [36]

大连化学物理研究所 [29]

清华大学 [14]

兰州理工大学 [14]

过程工程研究所 [14]

兰州化学物理研究所 [12]

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期刊论文 [142]

学位论文 [22]

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物理化学 [20]

多相催化 [2]

物理化学与绿色催化 [2]

Chemistry;... [1]

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半导体物理 [1]

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	First-principles study of the impact of hydrogen on the adsorption properties of Ti-decorated graphdiyne storage methane 期刊论文 Chemical Physics Letters, 2022, 卷号: 790 作者: Zhao, Qiuyu; Chen, Yuhong; Xu, Wenhui; Ju, Jiaming; Zhao, Yingjie 收藏 \| 浏览/下载：17/0 \| 提交时间：2022/04/21 Adsorption Density functional theory Hydrogen storage Titanium compounds Adsorption capacities Adsorption properties CH 4 Density-functional-theory First principles First-principle study Graphdiyne Methane and hydrogen mixed storage Negative charge Ti-decorated
	Gas-based reduction and carbonization of titanium minerals in titanium-bearing blast furnace slag: A combined thermodynamic, experimental and DFT study 期刊论文 International Journal of Hydrogen Energy, 2022, 卷号: 47, 期号: 12, 页码: 7586-7599 作者: Zhang, Run; Hou, Youling; Fan, Gangqiang; Huang, Dejun; Ding, Xiaoming 收藏 \| 浏览/下载：42/0 \| 提交时间：2022/04/21 Blast furnaces Iron oxides Magnesia Metal recovery Perovskite Reaction kinetics Temperature Carbonisation CH 4 DFT study Gas-based reductions High-content Thermodynamic studies Titania Titania-bearing blast furnace slag Titanium minerals Titanium-bearing blast furnace slag
	A first principles study of hydrogen storage capacity for Li-decorated porous BNC monolayer 期刊论文 COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2022, 卷号: 1208 作者: Yuan, Lihua; Gong, Jijun; Wang, Daobin; Su, Junyan; Zhang, Meiling 收藏 \| 浏览/下载：24/0 \| 提交时间：2022/03/01 First-principles Hydrogen storage Porous boron-nitride-carbon
	Spontaneous dissociation of H-2 and high energy barrier of H invasion on W doped Al2O3(0001) surface 期刊论文 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2022, 卷号: 47 作者: Long, Qian; Guo, Chunsheng; Xin, Xiaojun; Ding, Rui; Luo, Laima 收藏 \| 浏览/下载：49/0 \| 提交时间：2022/02/14 W dopedAl(2)O(3) H-2 dissociation Hydrogen adsorption Hydrogen diffusion Hydrogen permeation barrier
	Friction behavior and structural evolution of hexagonal boron nitride: a relation to environmental molecules containing −OH functional group 期刊论文 ACS APPLIED MATERIALS & INTERFACES, 2022, 卷号: 14, 期号: 25, 页码: 29462–29463 作者: Bai Changning; Zhang Bin 收藏 \| 浏览/下载：0/0 \| 提交时间：2023/12/08 hexagonal boron nitride friction behavior structural evolution first-principles calculations dissociative adsorption
	Tetraphenyladamantane-based microporous polyaminals for efficient adsorption of CO2, H-2 and organic vapors 期刊论文 MICROPOROUS AND MESOPOROUS MATERIALS, 2021, 卷号: 323, 页码: 11 作者: Rong, Meng; Yang, Liangrong; Yang, Chao; Yu, Jiemiao; Liu, Huizhou 收藏 \| 浏览/下载：16/0 \| 提交时间：2021/08/31 Tetrapheyladamantane Polyaminal CO2 adsorption H-2 adsorption Organic vapor capture
	Research on Maintaining High Vacuum in High Vacuum Multilayer Insulation Equipment of Hydrogen Getters 期刊论文 Cailiao Daobao/Materials Reports, 2021, 卷号: 35, 期号: 14, 页码: 14035-14039 作者: Yu, Yang; Zhu, Ming; Chen, Shuping; Gu, Chunlin; Zhang, Bo 收藏 \| 浏览/下载：13/0 \| 提交时间：2022/02/17 Adsorption Cryogenic equipment Deterioration Electrocardiography Hydrogen Insulation Metals Multilayers Vacuum applications Adsorption performance Equilibrium pressure Experimental devices High vacuum multilayer insulations Insulation capacity Insulation materials Insulation performance Transportation industry
	Hydrogen and CO2 storage in high surface area covalent triazine–based frameworks 会议论文作者: Deng, Q.-W.; Ren, G.-Q.; Li, Y.-J.; Yang, L.; Zhai, S.-L. 收藏 \| 浏览/下载：4/0 \| 提交时间：2020/12/18 Adsorption Carbon dioxide Hydrogen fuels Monte Carlo methodsAdsorption mechanism Ambient conditions Annealing treatments CO2 adsorption Defects induced Grand canonical Monte carlo High adsorption capacity High surface area
	Hydrogen and CO2 storage in high surface area covalent triazine–based frameworks 期刊论文 Materials Today Energy, 2020, 卷号: 18 作者: Deng, Q.-W.; Ren, G.-Q.; Li, Y.-J.; Yang, L.; Zhai, S.-L. 收藏 \| 浏览/下载：5/0 \| 提交时间：2020/11/14 Adsorption Carbon dioxide Hydrogen fuels Monte Carlo methods Adsorption mechanism Ambient conditions Annealing treatments CO2 adsorption Defects induced Grand canonical Monte carlo High adsorption capacity High surface area
	Reaction performance and lattice oxygen migration of MnFe2O4 oxygen carrier in methane-carbon dioxide reaction system 期刊论文 INTERNATIONAL JOURNAL OF HYDROGEN ENERGY, 2020, 卷号: 45, 期号: 55, 页码: 30254-30266 作者: Zhou, Huan; Yi, Qun; Wei, Guoqiang; Zhang, Yuke; Hou, Yalei 收藏 \| 浏览/下载：34/0 \| 提交时间：2021/11/01 CLPOM MnFe2O4 Lattice oxygen Oxygen carriers Synergistic

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