Zobrazeno 1 - 10
of 91
pro vyhledávání: '"Chaofan Sun"'
Publikováno v:
Journal of Chemistry, Vol 2015 (2015)
The ground state structures, HOMO and LUMO energy levels, band gaps ΔH-L, ionization potentials (IP), and electron affinities (EA) of three types of copolymer P1 and its derivatives P2, P3, and PBDT-BTA were investigated by using density functional
Externí odkaz:
https://doaj.org/article/6f050ee80f184ca8b3737a7d24fc869e
Autor:
Chaofan Sun1, Huimin Zhou1, Yujia Jiang1, Yuanli Zhang1, Guilong Fu1, Huicheng Xie1,2 xiehc@sdau.edu.cn
Publikováno v:
Polish Journal of Environmental Studies. 2023, Vol. 32 Issue 1, p745-753. 9p.
Publikováno v:
Applied Mathematical Modelling. 119:196-217
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b5f278ecb0766bb41862416f5d49a66b
https://doi.org/10.1016/j.apm.2023.02.022
https://doi.org/10.1016/j.apm.2023.02.022
Publikováno v:
Polish Journal of Environmental Studies. 32:745-753
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::319f020669399b69cd94de44391fd250
https://doi.org/10.15244/pjoes/154824
https://doi.org/10.15244/pjoes/154824
Publikováno v:
Inorganic Chemistry. 61:9623-9630
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::777b156404243133d5d554760b27c39a
https://doi.org/10.1021/acs.inorgchem.2c00993
https://doi.org/10.1021/acs.inorgchem.2c00993
Publikováno v:
Journal of Molecular Modeling. 29
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::55e732409335bb985e03aafc4bfe7476
https://doi.org/10.1007/s00894-023-05541-4
https://doi.org/10.1007/s00894-023-05541-4
Publikováno v:
ACS Omega. 7:14848-14855
Two novel compounds (HQS and HQSe) with excited-state intramolecular proton transfer (ESIPT) properties were designed based on the compound 2-(2-hydroxy-3-ethoxyphenyl)-3
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::459db69c5be9c1836b8ce1797fc34646
https://doi.org/10.1021/acsomega.2c00316
https://doi.org/10.1021/acsomega.2c00316
Publikováno v:
Industrial Crops and Products. 200:116851
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5d8245a59098701ecfc7349488eb6816
https://doi.org/10.1016/j.indcrop.2023.116851
https://doi.org/10.1016/j.indcrop.2023.116851
Publikováno v:
Physical Chemistry Chemical Physics. 24:8453-8462
The proton transfer process in anti and syn forms distinctively occurs along the excited-state weakened IHB. Based on quantum chemical calculations, it can be unveiled that only the single proton transfer reaction could occur along N1–H2⋯O3.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8159a3f681e94be4314b94e03b5e97ab
https://doi.org/10.1039/d1cp05584d
https://doi.org/10.1039/d1cp05584d
Autor:
Jun‐Jie Wu, Shuwen Yu, Yanping Liu, Chang‐Cun Yan, Wan‐Ying Yang, Wanfeng Xie, Xue‐Dong Wang, Chaofan Sun, Liang‐Sheng Liao
Publikováno v:
Advanced Functional Materials. 33
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::990fda8cc91d6610f5ca12ae32735c52
https://doi.org/10.1002/adfm.202214308
https://doi.org/10.1002/adfm.202214308