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Improved Quantum-Classical Treatment of N2-N2 Inelastic Collisions: Effect of the Potentials and Complete Rate Coefficient Data Sets 期刊论文
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2023, 卷号: 19, 期号: 23, 页码: 8557-8571
作者:  Hong QZ(洪启臻);  Storchi, Loriano;  Sun QH(孙泉华);  Bartolomei, Massimiliano;  Pirani, Fernando
收藏  |  浏览/下载:1/0  |  提交时间:2024/01/22
Sinunanolobatone A, an Anti-inflammatory Diterpenoid with Bicyclo[13.1.0]pentadecane Carbon Scaffold, and Related Casbanes from the Sanya Soft Coral Sinularia nanolobata 期刊论文
ORGANIC LETTERS, 2021, 卷号: 23, 期号: 19, 页码: 7575-7579
作者:  Zeng, Zi-Rong;  Li, Wang-Sheng;  Nay, Bastien;  Hu, Pei;  Zhang, Hai-Yan
收藏  |  浏览/下载:19/0  |  提交时间:2021/12/01
Revealing the role of nitrogen dopants in tuning the electronic and optical properties of graphene quantum dots via a TD-DFT study 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2020, 卷号: 22, 期号: 48, 页码: 28230-28237
作者:  Yang, Min;  Lian, Zan;  Si, Chaowei;  Li, Bo
收藏  |  浏览/下载:16/0  |  提交时间:2021/03/15
The catalytic performance of metal-free defected carbon catalyst towards acetylene hydrochlorination revealed from first-principles calculation 期刊论文
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2020, 页码: 8
作者:  Ali, Sajjad;  Khan, Muhammad Baber Azam;  Khan, Said Alam;  Noora
收藏  |  浏览/下载:22/0  |  提交时间:2021/02/02
Complex Polypropionates from a South China Sea Photosynthetic Mollusk: Isolation and Biomimetic Synthesis Highlighting Novel Rearrangements 期刊论文
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2020, 页码: 9
作者:  Wu, Qihao;  Li, Song-Wei;  Xu, Heng;  Wang, Hong;  Hu, Pei
收藏  |  浏览/下载:38/0  |  提交时间:2020/07/01
Molecular dynamics simulation of lateral ultrasonic excitation in atomic-scale friction 期刊论文
Materials Research Express, 2020, 卷号: 7, 期号: 1
作者:  Wang, Zining;  Duan, Zaoqi;  Dong, Yun;  Zhang, Yan
收藏  |  浏览/下载:6/0  |  提交时间:2020/11/14
Reactivity descriptors of diverse copper-oxo species on ZSM-5 zeolite towards methane activation 期刊论文
CATALYSIS TODAY, 2019, 卷号: 338, 页码: 108-116
作者:  Wang, Guiru;  Chen, Wei;  Huang, Ling;  Liu, Zhiqiang;  Sun, Xianyong
收藏  |  浏览/下载:65/0  |  提交时间:2019/12/06
Klyflaccilides A and B, Diterpenoids with 6/5/8/3 Fused Tetracyclic Carbon Skeleton from the Hainan Soft Coral Klyxum flaccidum 期刊论文
ORGANIC LETTERS, 2019, 卷号: 21, 期号: 14, 页码: 5660-5664
作者:  Li, Geng;  Li, Heng;  Tang, Wei;  Guo, Yue-Wei;  Li, Xu-Wen
收藏  |  浏览/下载:40/0  |  提交时间:2020/07/01
Structurally diverse diterpenoids from Isodon ternifolius collected from three regions 期刊论文
TETRAHEDRON, 2019, 卷号: 75, 期号: 19, 页码: 2797-2806
作者:  Gou, Lei-Lei;  Hu, Kun;  Yang, Qian;  Li, Xiao-Nian;  Sun, Han-Dong
收藏  |  浏览/下载:56/0  |  提交时间:2019/06/24


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