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CAS IR Grid
机构
宁波材料技术与工程研... [5]
物理研究所 [1]
化学研究所 [1]
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OAI收割 [7]
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会议论文 [5]
期刊论文 [2]
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2015 [1]
2014 [1]
2013 [3]
2011 [1]
2008 [1]
学科主题
Chemistry [5]
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Push-Pull Type Oligo(N-annulated perylene)quinodimethanes: Chain Length and Solvent-Dependent Ground States and Physical Properties
会议论文
OAI收割
作者:
Zeng, Zebing
;
Lee, Sangsu
;
Son, Minjung
;
Fukuda, Kotaro
;
Mayorga Burrezo, Paula
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2021/12/02
NONLINEAR-OPTICAL PROPERTIES
EXTENDED P-QUINODIMETHANES
OPEN-SHELL
2ND HYPERPOLARIZABILITIES
QUINOIDAL OLIGOTHIOPHENES
DIRADICAL CHARACTER
BIRADICAL CHARACTERS
2-PHOTON ABSORPTION
ELECTRON-ACCEPTORS
CLOSED-SHELL
para-Quinodimethane- Bridged Perylene Dimers and Pericondensed Quaterrylenes: The Effect of the Fusion Mode on the Ground States and Physical Properties
会议论文
OAI收割
作者:
Das, Soumyajit
;
Lee, Sangsu
;
Son, Minjung
;
Zhu, Xiaojian
;
Zhang, Wenhua
  |  
收藏
  |  
浏览/下载:28/0
  |  
提交时间:2021/12/02
OPEN-SHELL
PHOTOPHYSICAL PROPERTIES
GRAPHENE NANORIBBONS
KEKULE STRUCTURES
CLOSED-SHELL
HYDROCARBONS
DYES
ABSORPTION
CHARACTER
AROMATICITY
Pushing Extended p-Quinodimethanes to the Limit: Stable Tetracyano-oligo(N-annulated perylene)quinodimethanes with Tunable Ground States
会议论文
OAI收割
作者:
Zeng, Zebing
;
Ishida, Masatoshi
;
Zafra, Jose L.
;
Zhu, Xiaojian
;
Sung, Young Mo
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2021/12/02
OPEN-SHELL
QUINOIDAL OLIGOTHIOPHENES
ELECTRON-ACCEPTORS
CLOSED-SHELL
TETRACYANODIPHENOQUINODIMETHANE
HYDROCARBONS
AROMATICITY
ABSORPTION
CHEMISTRY
ANALOGS
Dibenzoheptazethrene Isomers with Different Biradical Characters: An Exercise of Clar's Aromatic Sextet Rule in Singlet Biradicaloids
会议论文
OAI收割
作者:
Sun, Zhe
;
Lee, Sangsu
;
Park, Kyu Hyung
;
Zhu, Xiaojian
;
Zhang, Wenhua
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2021/12/02
OPEN-SHELL
CLOSED-SHELL
HYDROCARBON
ABSORPTION
STATE
Tetracyanoquaterrylene and Tetracyanohexarylenequinodimethanes with Tunable Ground States and Strong Near-Infrared Absorption
会议论文
OAI收割
作者:
Zeng, Zebing
;
Lee, Sangsu
;
Zafra, Jose L.
;
Ishida, Masatoshi
;
Zhu, Xiaojian
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2021/12/02
OPEN-SHELL
QUINOIDAL OLIGOTHIOPHENES
GRAPHENE NANORIBBONS
ELECTRONIC-STRUCTURE
2-PHOTON ABSORPTION
KEKULE STRUCTURES
CLOSED-SHELL
CHARACTER
HYDROCARBON
MOLECULES
On the performance of the open-shell perturbation theory
期刊论文
OAI收割
SCIENCE CHINA-CHEMISTRY, 2011, 卷号: 54, 期号: 3, 页码: 446-453
作者:
Chen FeiWu
;
Wei MeiJu
;
Liu WenJian
  |  
收藏
  |  
浏览/下载:22/0
  |  
提交时间:2019/04/09
Open Shell
Perturbation Theory
Convergence
Bond Length
Harmonic Vibrational Frequency
Local configuration interaction single excitation approach: Application to singlet and triplet excited states structure for conjugated chains
期刊论文
OAI收割
SYNTHETIC METALS, 2008, 卷号: 158, 期号: 8-9, 页码: 330
Li, QX
;
Li, QK
;
Shuai, ZG
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2013/09/18
COUPLED-CLUSTER THEORY
SYMMETRY-ADAPTED-CLUSTER
WAVE-FUNCTION
ELECTRON CORRELATION
ORBITAL THEORY
OPEN-SHELL
LARGE MOLECULES
EXPANSION
POLYMERS
DENSITY