Zobrazeno 1 - 5
of 5
pro vyhledávání: '"Zi-Man Jia"'
Publikováno v:
Atmospheric Environment. 183:135-143
In this work, a systematic investigation of the atmospheric oxidation mechanism of (CF3)2CXOCH3 and their oxidative products (CF3)2CXOCHO (X = H, F) initiated by OH radical or Cl atom is performed by density functional theory. This study reveals that
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6095d3aa750646510626d795b4065294
https://doi.org/10.1016/j.atmosenv.2018.04.002
https://doi.org/10.1016/j.atmosenv.2018.04.002
Publikováno v:
ChemPhysChem. 16:1768-1776
The mechanism and kinetics of the reactions of CF(3)COOCH(2)CH(3), CF(2)HCOOCH(3), and CF(3)COOCH(3) with Cl and OH radicals are studied using the B3LYP, MP2, BHandHLYP, and M06-2X methods with the 6-311G(d,p) basis set. The study is further refined
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::30ab7f574fa97a199d3b7bd4b07de57e
https://doi.org/10.1002/cphc.201402799
https://doi.org/10.1002/cphc.201402799
Publikováno v:
Journal of Molecular Modeling. 20
The reaction of CHF2OCF2CHFCl with atomic chlorine was studied using B3LYP/6-311G(d,p), BHandHLYP/6-311G(d,p), and M06-2X/6-311G(d,p) methods and further using CCSD(T) and QCISD(T) methods. Two hydrogen abstraction channels were found for the title r
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::09e0c2ee21dbb3b13b1c662da0ec42f4
https://doi.org/10.1007/s00894-014-2419-x
https://doi.org/10.1007/s00894-014-2419-x
Autor:
Bai, Feng‐Yang, Zhu, Xiao‐Le, Jia, Zi‐Man, Wang, Xu, Sun, Yan‐Qiu, Wang, Rong‐Shun, Pan, Xiu‐Mei
Publikováno v:
ChemPhysChem; Jun2015, Vol. 16 Issue 8, p1768-1776, 9p
Autor:
Xi Xiang
As the sixth volume of a multivolume set on the Chinese language, this book studies the influence of foreign culture on Middle Chinese lexicon and the development of synonyms, idioms, and proverbs during the period.Focusing on lexicons in Middle Chin
