De-Cai Fang

Publication Activity (10 Years)

Years Active: 2018-2023
Publications (10 Years): 12

Top Topics

Density Functional Theory

Room Temperature

Energy Transfer

Top Venues

Physical chemistry chemical physics : PCCP

Organic letters

The Journal of organic chemistry

Inorganic chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

De-Cai Fang, Si-Cong Liu, Dan-Yang Liu, Xin-Rui Zhu
The treatment of dispersion terms for solution systems. Physical chemistry chemical physics : PCCP (2023)
Si-Cong Liu, De-Cai Fang
DFT Studies on the Mechanisms of Carboamination/Diamination of Unactivated Alkenes Mediated by Pd(IV) Intermediates. The Journal of organic chemistry (2023)
Jing-Dong Zhang, Xiao-Jie Gao, Si-Cong Liu, Zhu-Feng Geng, Le Chang, Yi-Jiang Liu, Qing-Yu Ma, Guo-Wen Xing, Guang-Jian Liu, De-Cai Fang
α-Stereoselective 3-Deoxy-d- manno -oct-2-ulosonoic Acid (Kdo) O -Glycosylation with a p -Toluenethioglycoside Donor by the ( p -Tol) 2 SO/Tf 2 O Preactivation Strategy. Organic letters (2023)
Si-Cong Liu, Xin-Rui Zhu, Dan-Yang Liu, De-Cai Fang
DFT calculations in solution systems: solvation energy, dispersion energy and entropy. Physical chemistry chemical physics : PCCP 25 (2) (2023)
Shi-Jun Li, Wei Fang, Jeremy O Richardson, De-Cai Fang
Tunnelling assisted hydrogen elimination mechanisms of FeCl 3 /TEMPO. Chemical communications (Cambridge, England) 58 (4) (2022)
Si-Cong Liu, Xin-Rui Zhu, Dan-Yang Liu, De-Cai Fang
DFT calculations in solution systems: solvation energy, dispersion energy and entropy. Physical chemistry chemical physics : PCCP (2022)
Lei Zhang, Ling-Ling Wang, De-Cai Fang
DFT Case Study on the Comparison of Ruthenium-Catalyzed C-H Allylation, C-H Alkenylation, and Hydroarylation. ACS omega 7 (7) (2022)
Rui Liu, Yajie Chou, Bing Lian, De-Cai Fang, Ming Gao, Tanyu Cheng, Guohua Liu
Mechanistic Insights into the Ru(II)-Catalyzed Intramolecular Formal [3 + 2] Cycloaddition of (E)-1,6-Enynes. Organic letters 21 (17) (2019)
Shengyu Shi, Lifeng Yao, Linlin Li, Zehui Wu, Zhihao Zha, Hank F Kung, Lin Zhu, De-Cai Fang
Synthesis of novel technetium-99m tricarbonyl-HBED-CC complexes and structural prediction in solution by density functional theory calculation. Royal Society open science 6 (11) (2019)
Sai Li, Min Wu, Yang Kang, Han-Wen Zheng, Xiang-Jun Zheng, De-Cai Fang, Lin-Pei Jin
Grinding-Triggered Single Crystal-to-Single Crystal Transformation of a Zinc(II) Complex: Mechanochromic Luminescence and Aggregation-Induced Emission Properties. Inorganic chemistry 58 (7) (2019)
Bing Lian, Lei Zhang, Shi-Jun Li, Lu-Lu Zhang, De-Cai Fang
PdIV Species Mediation in PdII-Catalyzed Direct Alkylation of Arenes with Oxiranes: A DFT Study. The Journal of organic chemistry 83 (6) (2018)
Pingping Feng, Xinying Wang, Yushuang Zhao, De-Cai Fang, Xiaojing Yang
Energy transfer between rare earths in layered rare-earth hydroxides. RSC advances 8 (7) (2018)