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[会议论文] 作者：Rongjian Sa,Caiping Liu,Kechen Wu,
来源：中国化学会第五届全国结构化学学术会议 年份：2007
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[会议论文] 作者：Caiping Liu,Rongjian Sa,Kechen Wu,
来源：中国化学会第五届全国结构化学学术会议 年份：2007
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[会议论文] 作者：Jinyu Hu,Zuju Ma,Rongjian Sa,Kechen Wu,
来源：第十三届全国量子化学会议 年份：2017
Applications in laser frequency conversion and advanced optical communication have triggered a real interest about the properties of nonlinear optical(NLO)m...
Evaluation of Interactions between Urokinase Plasminogen and Inhibitors Using Free Energy Calculatio
[会议论文] 作者：Rongjian Sa,Liang Fang,Mingdong Huang,Qiaohong Li,Kechen Wu,
来源：第十二届全国量子化学会议 年份：2014
The binding modes of urokinase-type plasminogen activator(uPA)with five inhibitors(1-(7-Sulfonamidoisoquinolinyl)guanidine derivatives)were predicted based on molecular dynamic simulations.MM/PBSA fre...
Metalloporphyrin-based covalent organic frameworks composed of the electron donor-acceptor dyads for
[期刊论文] 作者：Haowei Lv,Rongjian Sa,Pengyue Li,Daqiang Yuan,Xinchen Wang,Ruihu Wang,
来源：中国科学:化学（英文版） 年份：2020
The visible-light-driven photocatalytic CO2 reduction with high efficiency is highly desirable but challenging.Herein,we present porphyrin-tetraphenylethene-bas...
Enhancing hydrogen evolution of MoS2 basal planes by combining single-boron catalyst and compressive
[期刊论文] 作者：Zhitao Cui,Wei Du,Chengwei Xiao,Qiaohong Li,Rongjian Sa,Chenghua Sun,Zuju Ma,
来源：物理学前沿 年份：2020
MoS2 is a promising candidate for hydrogen evolution reaction(HER),while its active sites are mainly distributed on the edge sites rather than the basal plane s...
Effect of rare-earth doping on adsorption of carbon atom on ferrum surface and in ferrum subsurface:
[期刊论文] 作者：Yang Yang,Xiang Zhou,Faqing Pan,Zuju Ma,Rongjian Sa,Jun Zheng,Qimin Wang,
来源：稀土学报:英文版 年份：2021
The adsorption of carbon atom on Fe surface and in Fe subsurface with and without rare earth(La and Ce)substitution in the surface layer and subsurface layer was studied by first-principles calculations.The carbon atom is predicted to adsor......
First principle study of electronic, optical and ferroelectric properties of BiFeO3 during hypotheti
[会议论文] 作者：Chao He,Zuju Ma,Baozhen Sun,Rongjian Sa,Xuemei Shi,Xiaochuan Zhao,Kechen Wu,
来源：第十二届全国量子化学会议 年份：2014
The electronic,linear and nonlinear optical properties,structure and its stability of BiFeO3 during polarization reversal from reference cubic phase to ferroelectric R3c phase were investigated by LSD...
[会议论文] 作者：Huiqin Qian,Rongjian Sa,Ming Xiang,Zengwei Luo,Xiaonian Li,Guangmin Yao,Yonghui Zhang,Junfen Zeng,Yongbo,
来源：第十四届全国中药和天然药物学术研讨会暨第十三届中药全球化联盟大会 年份：2014
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[会议论文] 作者：Junfen Zeng,Yongbo Xue,Penghua Shu,Huiqin Qian,Rongjian Sa,Ming Xiang,Zengwei Luo,Xiaonian Li,Guangmin,
来源：第十四届全国中药和天然药物学术研讨会暨第十三届中药全球化联盟大会 年份：2014
Cinnamomum cassia Presl (Lauraceae) originates in South China, its dried barks, also known as cortex cinnamomi, are used as not only spice and flavoring agents, but also a traditional Chinese medicine...
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