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浏览/检索结果: 共40条，第1-10条 帮助 限定条件 发表日期：2018    专题：大连化学物理研究所    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 Solvation effect on the ESIPT mechanism of 2-(4 '-amino-2 '-hydroxyphenyl)-1H-imidazo- [4,5-c]pyridine 期刊论文 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：65/0  |  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 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：79/0  |  提交时间：2019/05/08 Esipt  Molecular electrostatic potential surface  Frontier molecular orbitals  Potential-energy curves   Role of Oxygen Vacancies on Oxygen Evolution Reaction Activity: beta-Ga2O3 as a Case Study 期刊论文 CHEMISTRY OF MATERIALS, 2018, 卷号: 30, 期号: 21, 页码: 7714-7726 作者:  Liu, Taifeng;  Feng, Zhaochi;  Li, Qiuye 收藏  |  浏览/下载：12/0  |  提交时间：2019/06/20 Role of oxygen vacancies on oxygen evolution reaction activity: beta-ga2o3 as a case study 期刊论文 Chemistry of materials, 2018, 卷号: 30, 期号: 21, 页码: 7714-7726 作者:  Liu, Taifeng;  Feng, Zhaochi;  Li, Qiuye;  Yang, Jianjun;  Li, Can 收藏  |  浏览/下载：34/0  |  提交时间：2019/05/08 Rate coefficients of the H + H2O2 -> H-2 + HO2 reaction on an accurate fundamental invariant-neural network potential energy surface 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 149, 期号: 17, 页码: 7 作者:  Lu, Xiaoxiao;  Meng, Qingyong;  Wang, Xingan;  Fu, Bina;  Zhang, Dong H. 收藏  |  浏览/下载：16/0  |  提交时间：2019/06/20 Six-dimensional quantum dynamics for the dissociative chemisorption of HCl on rigid Ag(111) on three potential energy surfaces with different density functionals 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 149, 期号: 17, 页码: 8 作者:  Liu, Tianhui;  Fu, Bina;  Zhang, Dong H. 收藏  |  浏览/下载：30/0  |  提交时间：2019/06/20 Ultrathin IrRu nanowire networks with high performance and durability for the hydrogen oxidation reaction in alkaline anion exchange membrane fuel cells 期刊论文 JOURNAL OF MATERIALS CHEMISTRY A, 2018, 卷号: 6, 期号: 41, 页码: 20374-20382 作者:  Qin, Bowen;  Yu, Hongmei;  Gao, Xueqiang;  Yao, Dewei;  Sun, Xinye 收藏  |  浏览/下载：38/0  |  提交时间：2019/06/20 Quantum wavepacket method for state-to-state reactive cross sections in hyperspherical coordinates 期刊论文 JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 149, 期号: 17, 页码: 16 作者:  Xie, Daiqian;  Zhao, Hailin;  Hu, Xixi;  Sun, Zhigang 收藏  |  浏览/下载：28/0  |  提交时间：2019/06/20 Ultrathin irru nanowire networks with high performance and durability for the hydrogen oxidation reaction in alkaline anion exchange membrane fuel cells 期刊论文 Journal of materials chemistry a, 2018, 卷号: 6, 期号: 41, 页码: 20374-20382 作者:  Qin, Bowen;  Yu, Hongmei;  Gao, Xueqiang;  Yao, Dewei;  Sun, Xinye 收藏  |  浏览/下载：51/0  |  提交时间：2019/05/08 Rate coefficients of the h + h2o2 -> h-2 + ho2 reaction on an accurate fundamental invariant-neural network potential energy surface 期刊论文 Journal of chemical physics, 2018, 卷号: 149, 期号: 17, 页码: 7 作者:  Lu, Xiaoxiao;  Meng, Qingyong;  Wang, Xingan;  Fu, Bina;  Zhang, Dong H. 收藏  |  浏览/下载：45/0  |  提交时间：2019/05/08