机构

• 大连化学物理研究所 [16]
• 长春光学精密机械与物... [1]
• 化学研究所 [1]
• 生态环境研究中心 [1]

采集方式

• OAI收割 [18]
• iSwitch采集 [1]

内容类型

• 期刊论文 [19]

发表日期

• 2020 [1]
• 2019 [1]
• 2018 [4]
• 2017 [5]
• 2016 [2]
• 2015 [3]
• 更多

学科主题

筛选

浏览/检索结果: 共19条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 Synergistic Features of Superoxide Molecule Anchoring and Charge Transfer on Two-Dimensional Ti3C2Tx MXene for Efficient Peroxymonosulfate Activation 期刊论文  OAI收割 ACS APPLIED MATERIALS & INTERFACES, 2020, 卷号: 12, 期号: 8, 页码: 9209-9218 作者:  Ding, Mingmei;  Chen, Wei;  Xu, Hang;  Lu, Chunhui;  Lin, Tao   |  收藏  |  浏览/下载：32/0  |  提交时间：2021/09/15 Fenton-like reactions  Ti3C2Tx monolayer  dimensional reduction  frontier orbitals  active sites   A series of blue-green-yellow-red emitting Cu(I) complexes: Molecular structure and photophysical performance 期刊论文  OAI收割 Spectrochimica Acta Part a-Molecular and Biomolecular Spectroscopy, 2019, 卷号: 223, 页码: 8 作者:  L.M.Zhang;  Q.H.Zuo   |  收藏  |  浏览/下载：17/0  |  提交时间：2020/08/24 Phosphorescent Cu(I),Molecular structure,Conjugation plane,Frontier,molecular orbitals,ligand,photosensitizers,emission,Spectroscopy   Solvation effect on the ESIPT mechanism of 2-(4 '-amino-2 '-hydroxyphenyl)-1H-imidazo- [4,5-c]pyridine 期刊论文  OAI收割 JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2018, 卷号: 367, 页码: 261-269 作者:  Wang, Yi;  Tang, Zhe;  Lu, Meiheng;  Liu, Kangjing;  Zhao, Yanliang   |  收藏  |  浏览/下载：76/0  |  提交时间：2019/06/20 ESIPT  Molecular electrostatic potential surface  Frontier molecular orbitals  Potential-energy curves   Solvation effect on the esipt mechanism of 2-(4 '-amino-2 '-hydroxyphenyl)-1h-imidazo- [4,5-c]pyridine 期刊论文  iSwitch采集 Journal of photochemistry and photobiology a-chemistry, 2018, 卷号: 367, 页码: 261-269 作者:  Tang, Zhe;  Lu, Meiheng;  Liu, Kangjing;  Zhao, Yanliang;  Qi, Yutai 收藏  |  浏览/下载：90/0  |  提交时间：2019/05/08 Esipt  Molecular electrostatic potential surface  Frontier molecular orbitals  Potential-energy curves   A detailed DFT/TDDFT study on excited-state intramolecular hydrogen bonding dynamics and proton-transfer mechanism of 2-phenanthro[9,10-d]oxazol-2-yl-phenol 期刊论文  OAI收割 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 10, 页码: 8 作者:  Song, Xiaoyan;  Yang, Dapeng;  Zhang, Tianjie;  Yang, Guang;  Jia, Min   |  收藏  |  浏览/下载：24/0  |  提交时间：2019/06/20 ESIPT  frontier molecular orbitals  infrared spectra  intramolecular hydrogen bond   Solvent controlling excited state proton transfer reaction in quinoline/isoquinoline-pyrazole isomer QP-I: A theoretical study 期刊论文  OAI收割 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 1 作者:  Zheng, Rui;  Wang, Yusheng;  Song, Nahong;  Yang, Dapeng;  Yang, Guang   |  收藏  |  浏览/下载：27/0  |  提交时间：2019/06/20 Excited State Proton Transfer  Frontier Molecular Orbitals  Intramolecular Hydrogen Bond  Potential Energy Curves   A DFT/TDDFT Investigation of Excited State Dynamical Mechanism of (E)-1-((2,2-Diphenylhydrazono)methyl)naphthalen-2-ol 期刊论文  OAI收割 JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2017, 卷号: 64, 期号: 12, 页码: 1385-1391 作者:  Yang, Dapeng;  Wu, Jingyuan;  Jia, Min;  Song, Xiaoyan   |  收藏  |  浏览/下载：25/0  |  提交时间：2019/06/20 Electronic Spectra  Frontier Molecular Orbitals  Excited-state Intramolecular Proton Transfer  Potential Energy Surface   A theoretical study about excited state behaviour for imide compound N-cyclohexyl-3-hydroxyphthalimide and 3,6-dihydroxy-N-cyclohexylphthalimide 期刊论文  OAI收割 JOURNAL OF MOLECULAR LIQUIDS, 2017, 卷号: 241, 页码: 1003-1008 作者:  Song, Nahong;  Yang, Dapeng;  Zhao, Jinfeng;  Yang, Guang;  Zheng, Rui 收藏  |  浏览/下载：20/0  |  提交时间：2017/12/19 Hydrogen bond  Frontier molecular orbitals  ESIPT  Potential energy surface   A theoretical study about excited state behaviour for imide compound N-cyclohexyl-3-hydroxyphthalimide and 3,6-dihydroxy-N-cyclohexylphthalimide 期刊论文  OAI收割 JOURNAL OF MOLECULAR LIQUIDS, 2017, 卷号: 241, 页码: 1003-1008 作者:  Yang, Dapeng;  Zhao, Jinfeng;  Yang, Guang;  Song, Nahong;  Zheng, Rui 收藏  |  浏览/下载：23/0  |  提交时间：2017/12/19 Hydrogen bond  Frontier molecular orbitals  ESIPT  Potential energy surface   Theoretical Investigation of the ESIPT Mechanism for the 1-Hydroxy-9H-fluoren-9-one and 1-Hydroxy-11H-benzo[b]fluoren-11-one Chromophores 期刊论文  OAI收割 JOURNAL OF CLUSTER SCIENCE, 2017, 卷号: 28, 页码: 1191-1200 作者:  Zhang, Meixia;  Zhou, Qiao;  Zhang, Mengru;  Dai, Yumei;  Song, Peng   |  收藏  |  浏览/下载：23/0  |  提交时间：2017/10/29 Frontier Molecular Orbitals  Esipt  Electronic Spectra  Potential Energy Curves