机构

• 金属研究所 [31]
• 化学研究所 [7]
• 上海应用物理研究所 [7]
• 新疆理化技术研究所 [6]
• 大连化学物理研究所 [3]
• 合肥物质科学研究院 [3]
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采集方式

• OAI收割 [68]
• iSwitch采集 [2]

内容类型

• 期刊论文 [67]
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发表日期

• 2021 [3]
• 2020 [3]
• 2019 [2]
• 2018 [2]
• 2017 [4]
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学科主题

• Chemistry [2]
• Engineerin... [1]

筛选

浏览/检索结果: 共70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 Modes of occurrence of organically-associated arsenic in Ge-rich coal deposits 期刊论文  OAI收割 FUEL, 2024, 卷号: 371, 页码: 132067 作者:  Wei, Qiang;  Wang, Shaobin;  Zhao, Lei;  Zou, Jianhua   |  收藏  |  浏览/下载：13/0  |  提交时间：2024/07/12 Arsenic  Germanium  Coal  Modes of occurrence  Organic association  Theoretical calculations   Inverse Electron-Demanding Diels-Alder Reactions in the Chemical Synthesis of Prenylated Indole Alkaloids Containing a Bicycle[2.2.2]diazaoctane Moiety: A Theoretical Study 期刊论文  OAI收割 CHEMISTRY-AN ASIAN JOURNAL, 2023, 卷号: 18, 期号: 7 作者:  Xu,Wenqiang;  Sun,Tian-Yu;  Di,Yingtong;  Hao,Xiaojiang;  Wu,Yun-Dong   |  收藏  |  浏览/下载：8/0  |  提交时间：2024/07/10 alkaloids  chemical synthesis  inverse-electron demanding Diels-Alder reaction  reaction mechanisms  theoretical study  BIOMIMETIC TOTAL-SYNTHESIS  CORRELATED MOLECULAR CALCULATIONS  MARINE-DERIVED FUNGUS  GAUSSIAN-BASIS SETS  (-)-VERSICOLAMIDE B  ORBITAL METHODS  BREVIANAMIDE-A  STEPHACIDIN-A  MODEL  CONCISE   High-contrast, reversible change of thermal conductivity in hexagonal nickel-iron sulfides 期刊论文  OAI收割 ACTA MATERIALIA, 2021, 卷号: 208 作者:  Zhang, X. K.;  Li, J. Y.;  Lin, J. C.;  Tong, P.;  Wang, M.   |  收藏  |  浏览/下载：26/0  |  提交时间：2021/05/17 Thermal regulation  First-order phase transition  High-contrast thermal conductivity change  Theoretical calculations  Hexagonal nickel sulfides   Theoretical study of the interplay between double chalcogen-bonding interactions and halogen bonds in ditopic molecular module systems 期刊论文  OAI收割 COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2021, 卷号: 1198, 页码: 10 作者:  Wu, Han;  Lu, Yunxiang;  Peng, Changjun;  Xu, Zhijian;  Liu, Honglai   |  收藏  |  浏览/下载：35/0  |  提交时间：2021/05/24 Double chalcogen bonds  Halogen bonds  Energetic effects  Ditopic modules  Theoretical calculations   Prediction of Novel van der Waals Boron Oxides with Superior Deep-Ultraviolet Nonlinear Optical Performance 期刊论文  OAI收割 ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2021, 卷号: 60, 期号: 19, 页码: 10791-10797 作者:  Li, H (Li, Hao)[ 1,2,3 ];  Min, JM (Min, Jingmei)[ 1 ];  Yang, ZH (Yang, Zhihua)[ 1,2 ];  Wang, ZH (Wang, Zhenhai)[ 3,4 ];  Pan, SL (Pan, Shilie)[ 1,2 ]   |  收藏  |  浏览/下载：63/0  |  提交时间：2021/05/06 boron oxides  crystal structure prediction  deep-ultraviolet nonlinear optical material  theoretical calculations  van der Waals   Norcolocynthenins A and B, two cucurbitane 3-nor-Triterpenoids from Citrullus colocynthis and their cytotoxicity 期刊论文  OAI收割 BIOORGANIC CHEMISTRY, 2020, 卷号: 101, 期号: 8, 页码: 1-5 作者:  Liu, YS (Liu, Yushuang)[ 1,2,4 ];  Zhang, L (Zhang, Lu)[ 1 ];  Xue, JJ (Xue, Jingjing)[ 3 ];  Wang, KB (Wang, Kaibo)[ 4 ];  Hua, HM (Hua, Huiming)[ 3 ]   |  收藏  |  浏览/下载：37/0  |  提交时间：2020/09/09 Citrullus colocynthis  Cucurbitane nortriterpenoid  Theoretical calculations  Cytotoxicity   An oxygen vacancy-rich two-dimensional Au/TiO2 hybrid for synergistically enhanced electrochemical N2 activation and reduction 期刊论文  OAI收割 Journal of Materials Chemistry A, 2020, 卷号: 8, 期号: 14, 页码: 6586-6596 作者:  Zhao, Sen   |  收藏  |  浏览/下载：67/0  |  提交时间：2021/09/06 Gold compounds  Ammonia  Catalyst selectivity  Chemical activation  Electrocatalysts  Electronic structure  Nitrogen  Oxide minerals  Oxygen  Oxygen vacancies  Reduction  Titanium dioxide  Electrocatalytic activity  Electron  donating effects  Faradaic efficiencies  Nitrogen reduction  Rate  limiting steps  Reversible hydrogen electrodes  Technical challenges  Theoretical calculations   End-On Cyanogen Complexes of Iridium, Palladium, and Platinum 期刊论文  OAI收割 INORGANIC CHEMISTRY, 2020, 卷号: 59, 期号: 9, 页码: 6489-6495 作者:  Chen, XT;  Xiong, ZX;  Andrews, L;  Gong, Y   |  收藏  |  浏览/下载：28/0  |  提交时间：2021/09/06 MATRIX INFRARED-SPECTRA  ANION PHOTOELECTRON-SPECTROSCOPY  DENSITY-FUNCTIONAL CALCULATIONS  LASER-ABLATED PLATINUM  THEORETICAL INVESTIGATIONS  COORDINATION CHEMISTRY  HYDROGEN-CYANIDE  BASIS-SETS  ATOMS  NICKEL   Side-On Sulfur Monoxide Complexes of Tantalum, Niobium, and Vanadium Oxyfluorides 期刊论文  OAI收割 INORGANIC CHEMISTRY, 2019, 卷号: 58, 期号: 6, 页码: 3807—3814 作者:  Wei, R;  Chen, XT;  Gong, Y   |  收藏  |  浏览/下载：31/0  |  提交时间：2019/12/30 GAUSSIAN-BASIS SETS  INFRARED-SPECTRA  THEORETICAL INVESTIGATIONS  MOLECULAR CALCULATIONS  ATOM REACTIONS  TRIPLE BONDS  METAL ATOM  COORDINATION  ACTIVATION  TITANIUM   Bidentate Sulfur Dioxide Complexes of Scandium, Yttrium, and Lanthanum Difluorides 期刊论文  OAI收割 INORGANIC CHEMISTRY, 2019, 卷号: 58, 期号: 8, 页码: 5281—5288 作者:  Wei, R;  Chen, XT;  Gong, Y   |  收藏  |  浏览/下载：37/0  |  提交时间：2019/12/30 GAUSSIAN-BASIS SETS  INFRARED-SPECTRA  THEORETICAL INVESTIGATIONS  MOLECULAR CALCULATIONS  REVERSIBLE BINDING  OXYGEN DIFLUORIDE  ATOMS  SO2  SINGLE  PLANAR