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浏览/检索结果: 共8条，第1-8条 帮助 限定条件 专题：山东大学    第一署名单位    第一作者单位    通讯作者单位     已选(0)清除 条数/页：5101520253035404550556065707580859095100   排序方式：请选择作者升序作者降序题名升序题名降序发表日期升序发表日期降序提交时间升序提交时间降序 Theoretical study of charge-transport and optical properties of organic crystals: 4,5,9,10-pyrenediimides 期刊论文 IUCRJ, 2019, 卷号: 6, 页码: 603-609 作者:  Huang, Jin-Dou;  Yu, Kun;  Huang, Xiaohua;  Chen, Dengyi;  Wen, Jing 收藏  |  浏览/下载：3/0  |  提交时间：2019/12/11 pyrenediimides  charge-carrier mobility  time-dependent density  functional theory  structure-property relationships   Modulating NeH-based excited-state intramolecular proton transfer by different electron-donating/withdrawing substituents in 2-(2 '-aminophenyl) benzothiazole compounds 期刊论文 CHEMICAL PHYSICS LETTERS, 2019, 卷号: 724, 页码: 57-66 作者:  Yang, Dapeng;  Zhang, Tianjie;  Jia, Min;  Cheng, Shibo 收藏  |  浏览/下载：1/0  |  提交时间：2019/12/11 N-H-based excited-state intramolecular proton transfer  Electron-donating/withdrawing substituents  Potential energy curves  TDDFT method   Research on mine dust suppression by spraying: Development of an air-assisted PM10 control device based on CFD technology 期刊论文 ADVANCED POWDER TECHNOLOGY, 2019, 卷号: 30, 期号: 11, 页码: 2588-2599 作者:  Peng, Huitian;  Nie, Wen;  Yu, Haiming;  Cheng, Weimin;  Bai, Peng 收藏  |  浏览/下载：8/0  |  提交时间：2019/12/11 Fully-mechanized mining face  Spraying dedusting device  PM10 control  Experimental analysis  CFD Simulation   Modulating N–H-based excited-state intramolecular proton transfer by different electron-donating/withdrawing substituents in 2-(2″-aminophenyl)benzothiazole compounds 期刊论文 Chemical Physics Letters, 2019, 页码: 57-66 作者:  Yang, Dapeng;  Zhang, Tianjie;  Jia, Min;  Cheng, Shibo 收藏  |  浏览/下载：4/0  |  提交时间：2019/12/11 Electron-donating/withdrawing substituents  N–H-based excited-state intramolecular proton transfer  Potential energy curves  TDDFT method   Photoinduced excited state dynamical behavior and ESIPT mechanism for 2-(2-hydroxy-3,5-dimethyl-phenyl)-benzooxazole-5-carboxylicacid molecule 期刊论文 CHEMICAL PHYSICS LETTERS, 2019, 卷号: 730, 页码: 485-490 作者:  Zhang, Qiaoli;  Yang, Xiaohui;  Yang, Dapeng;  Cheng, Shibo 收藏  |  浏览/下载：5/0  |  提交时间：2019/12/11 Intramolecular hydrogen bond  ESIPT  Charge transfer  Frontier molecular  orbital  Potential energy barrier   A detailed theoretical simulation about the excited state dynamical process for the novel (benzo[d]thiazol-2-yl)-5-(9H-carbazol-9-yl)phenol molecule 期刊论文 JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 卷号: 32, 期号: 6 作者:  Zhang, Qiaoli;  Zhang, Tianjie;  Cheng, Shibo;  Yang, Guang;  Jia, Min 收藏  |  浏览/下载：10/0  |  提交时间：2019/12/11 charge transfer  ESIPT  intramolecular hydrogen bond  IRC  transition  state   Unusual Indirect Nuclear Spin-Spin Exchange Coupling through Solvated Electron 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2018, 卷号: 9, 期号: 4, 页码: 689-695 作者:  Zhang, Changzhe;  Luo, Qi;  Cheng, Shibo;  Bu, Yuxiang 收藏  |  浏览/下载：5/0  |  提交时间：2019/12/11 Unique Solvating Effect in Azabenzene Clathrate Hydrates 期刊论文 JOURNAL OF PHYSICAL CHEMISTRY C, 2018, 卷号: 122, 期号: 50, 页码: 28466-28477 作者:  Zhang, Hongshu;  Luo, Qi;  Cheng, Shibo;  Fu, Qiang;  Bu, Yuxiang 收藏  |  浏览/下载：8/0  |  提交时间：2019/12/11