机构

• 高能物理研究所 [7]

采集方式

• OAI收割 [4]
• iSwitch采集 [3]

内容类型

• 期刊论文 [7]

发表日期

• 2017 [6]
• 2015 [1]

学科主题

• Chemistry [1]

筛选

浏览/检索结果: 共7条，第1-7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 A theoretical study on geometry, bonding nature, and stability of several anhydrous and hydrated in(iii), gd(iii) and yb(iii) complexes in liquid scintillator solvents 期刊论文  iSwitch采集 Inorganica chimica acta, 2017, 卷号: 463, 页码: 20-28 作者:  Huang, Pin-Wen;  Wang, Cong-Zhi;  Chai, Zhi-Fang;  Shi, Wei-Qun 收藏  |  浏览/下载：32/0  |  提交时间：2019/04/23 Metal-loaded liquid scintillator  Metal carboxylates  Metal diketonates  Dft  Qtaim   Structures and uranium-uranium multiple bond of binuclear divalent uranium complex of pyrrolic schiff-base macrocycle: a relativistic dft probe 期刊论文  iSwitch采集 Acta chimica sinica, 2017, 卷号: 75, 期号: 5, 页码: 457-+ 作者:  Chen Fangyuan;  Qu Ning;  Wu Qunyan;  Zhang Hongxing;  Shi Weiqun 收藏  |  浏览/下载：50/0  |  提交时间：2019/04/23 Bimetallic u-ii polypyrrolic complexes  Electronic structures  Diuranium multiple bond  Qtaim  Relativistic dft   Metal-metal multiple bond in low-valent diuranium porphyrazines and its correlation with metal oxidation state: a relativistic dft study 期刊论文  iSwitch采集 Computational and theoretical chemistry, 2017, 卷号: 1108, 页码: 29-39 作者:  Qu, Ning;  Su, Dong-Mei;  Wu, Qun-Yan;  Shi, Wei-Qun;  Pan, Qing-Jiang 收藏  |  浏览/下载：29/0  |  提交时间：2019/04/23 Diuranium diporphyrazine  Metal-metal multiple bond  Electronic structures  Qtaim  Relativistic dft   A theoretical study on geometry, bonding nature, and stability of several anhydrous and hydrated In(III), Gd(III) and Yb(III) complexes in liquid scintillator solvents 期刊论文  OAI收割 INORGANICA CHIMICA ACTA, 2017, 卷号: 463, 页码: 20-28 作者:  Chai ZF(柴之芳);  Huang PW(黄品文);  Wang CZ(王聪芝);  Shi WQ(石伟群);  Huang, PW   |  收藏  |  浏览/下载：21/0  |  提交时间：2019/08/27 Metal-loaded liquid scintillator  Metal carboxylates  Metal diketonates  DFT  QTAIM   Metal-metal multiple bond in low-valent diuranium porphyrazines and its correlation with metal oxidation state: A relativistic DFT study 期刊论文  OAI收割 COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2017, 卷号: 1108, 页码: 29-39 作者:  Qu, N;  Su, DM;  Wu QY(吴群燕);  Shi WQ(石伟群);  Wu, QY   |  收藏  |  浏览/下载：29/0  |  提交时间：2019/08/27 Diuranium diporphyrazine  Metal-metal multiple bond  Electronic structures  QTAIM  Relativistic DFT   Structures and Uranium-Uranium Multiple Bond of Binuclear Divalent Uranium Complex of Pyrrolic Schiff-base Macrocycle: a Relativistic DFT Probe 期刊论文  OAI收割 ACTA CHIMICA SINICA化学学报, 2017, 卷号: 75, 期号: 5, 页码: 457-+ 作者:  Pan, QJ;  Shi, WQ;  Zhang, HX;  Wu, QY;  Wu HY(吴海燕)   |  收藏  |  浏览/下载：37/0  |  提交时间：2019/08/27 bimetallic U-II polypyrrolic complexes  electronic structures  diuranium multiple bond  QTAIM  relativistic DFT   Performance of Twelve Density Functional Theory Methods in the Characterization of Three Trivalent Uranium Complexes 期刊论文  OAI收割 ACTA PHYSICO-CHIMICA SINICA, 2015, 卷号: 31, 期号: 7, 页码: 1283-1301 作者:  Ding, WJ;  Fang, WH;  Chai ZF(柴之芳);  Wang DQ(王东琪);  Chai, ZF 收藏  |  浏览/下载：25/0  |  提交时间：2016/04/18 Density functional theory  Trivalent uranium complex  Computational actinide chemistry  QTAIM