Theoretical Chemistry Accounts

雜志介紹

Theoretical Chemistry Accounts雜志介紹

《Theoretical Chemistry Accounts》是一本以English為主的未開放獲取國際優秀期刊，中文名稱理論化學賬戶，本刊主要出版、報道化學-CHEMISTRY, PHYSICAL領域的研究動態以及在該領域取得的各方面的經驗和科研成果，介紹該領域有關本專業的最新進展，探討行業發展的思路和方法，以促進學術信息交流，提高行業發展。該刊已被國際權威數據庫SCIE收錄，為該領域相關學科的發展起到了良好的推動作用，也得到了本專業人員的廣泛認可。該刊最新影響因子為1.6，最新CiteScore 指數為3.4。

本刊近期中國學者發表的論文主要有：

• Study of the hydrogen evolution properties of cluster ConMoS (n=1-5) using density functional theory

  Author: Wang, Zhi-Yao; Fang, Zhi-Gang; Wang, Jie; Mao, Zhi-Long; Hou, Qian-Qian; Wu, Ting-Hui; Zheng, Xin-Xi; Song, Jia

• First-principles calculations of SnCo as potential anode materials for high-performance lithium-ion batteries and beyond

  Author: Huang, Zhuonan; Zhang, Meiguang

• Insights into the excited state hydrogen bond and proton transfer behaviors associated with solvent polarity for NHBQ fluorophore: a theoretical study

  Author: Dong, Hao; Jin, Bing; Fan, Liming; Zhao, Jinfeng; Li, Xiaoxiao

• Exploring the structural and electronic properties of double-Fe atom-doped Si<Subscript>20</Subscript> cluster by quantum chemical calculations

  Author: Sheng-Jie Lu

英文介紹

Theoretical Chemistry Accounts雜志英文介紹

TCA publishes papers in all fields of theoretical chemistry, computational chemistry, and modeling. Fundamental studies as well as applications are included in the scope. In many cases, theorists and computational chemists have special concerns which reach either across the vertical borders of the special disciplines in chemistry or else across the horizontal borders of structure, spectra, synthesis, and dynamics. TCA is especially interested in papers that impact upon multiple chemical disciplines.