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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [13]
西北高原生物研究所 [2]
长春应用化学研究所 [2]
上海应用物理研究所 [1]
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OAI收割 [18]
内容类型
期刊论文 [18]
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2021 [1]
2020 [1]
2019 [1]
2016 [2]
2015 [2]
2014 [2]
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学科主题
Chemistry [1]
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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
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Metalloids as halogen bond acceptors: A combined crystallographic data and theoretical investigation
期刊论文
OAI收割
CHEMICAL PHYSICS LETTERS, 2020, 卷号: 745, 页码: 6
作者:
Hong, Yumei
;
Lu, Yunxiang
;
Zhu, Zhengdan
;
Xu, Zhijian
;
Liu, Honglai
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Identification of an Overlooked Halogen-Bond Synthon and Its Application in Designing Fluorescent Materials
期刊论文
OAI收割
CHEMISTRY-A EUROPEAN JOURNAL, 2019, 卷号: 25, 期号: 26, 页码: 6584-6590
作者:
Cheng, Lu
;
Zhu, Bingqing
;
Ma, Xiaoyu
;
Zhang, Zaiyong
;
Wang, Jian-rong
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Cation-anion radical interactions between halopyridinium cations and metal dithiolene complexes [M(C2S2)(2)CN](-center dot): A theoretical study of halogen bonds in conducting or magnetic molecular materials
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2016, 卷号: 116, 期号: 24, 页码: 1872-1881
作者:
Zhao, Chengxi
;
Lu, Yunxiang
;
Wang, Guimin
;
Zhu, Weiliang
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Intramolecular halogen bonds in 1,2-aryldiyne molecules: a theoretical study
期刊论文
OAI收割
STRUCTURAL CHEMISTRY, 2016, 卷号: 27, 期号: 3, 页码: 907-917
作者:
Zhang, Yuchen
;
Lu, Yunxiang
;
Xu, Zhijian
;
Ding, Hairong
;
Wu, Weihong
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Theoretical studies of traditional and halogen-shared halogen bonds: the doped all-metal aromatic clusters MAl3 (-) (M = Si, Ge, Sn, Pb) as halogen bond acceptors
期刊论文
OAI收割
theoretical chemistry accounts, 2015, 卷号: 134, 期号: 12
作者:
Cheng, Na
;
Liu, Yongjun
;
Zhang, Changqiao
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Application of Polarizable Ellipsoidal Force Field Model to Pnicogen Bonds
期刊论文
OAI收割
JOURNAL OF COMPUTATIONAL CHEMISTRY, 2015, 卷号: 36, 期号: 7, 页码: 441—448
作者:
Liu, F
;
Du, LK
;
Gao, J
;
Wang, LL
;
Song, B
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Substituent and transition metal effects on halogen bonding: CSD search and theoretical study
期刊论文
OAI收割
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2014, 卷号: 1029, 页码: 21-25
作者:
Wu, Weihong
;
Lu, Yunxiang
;
Liu, Yingtao
;
Peng, Changjun
;
Liu, Honglai
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Strong halogen bonds between halo-perfluorobenzenes (C6F5X) and pyridine molecules: A combined theoretical and crystallographic data study
期刊论文
OAI收割
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2014, 卷号: 1027, 页码: 79-83
作者:
Shi, Qiaocui
;
Su, Hairong
;
Liu, Yingtao
;
Wu, Weihong
;
Lu, Yunxiang
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Weak energetic effects between halogen and hydrogen bonds in crystal structures of halo-perfluorobenzenes (X-PFCs) and pyrazine molecules: A computational study
期刊论文
OAI收割
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2013, 卷号: 1026, 页码: 1-6
作者:
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