Zobrazeno 1 - 4
of 4
pro vyhledávání: '"De‐ju Wei"'
Publikováno v:
ACS Omega, Vol 6, Iss 48, Pp 32841-32851 (2021)
In this paper, the pyrolytic mechanisms of n-perfluorosilanes SinF2n+2 (2 ≤ n < 6) and perfluorocyclosilanes SinF2n (3 ≤ n ≤ 6) are studied in terms of kinetics and thermodynamics by theoretical ca...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f00d553aee23ea4c425de6dec73f1f03
https://doaj.org/article/93f9a4d066b44995a290bd3ebe720986
https://doaj.org/article/93f9a4d066b44995a290bd3ebe720986
Publikováno v:
RSC Advances. 11:21832-21839
In this paper, we construct a SixFy (x ≤ 6, y ≤ 12) series optimised at the B3LYP/6-31G(d,p) level. At the same level, we perform frontline molecular orbital (FMO), Mayer bond order (MBO), molecular surface electrostatic potential (MS-EPS) and na
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::aae2df519001bfe62b0775f7f0b99df8
https://doi.org/10.1039/d1ra03526f
https://doi.org/10.1039/d1ra03526f
Autor:
Li‐jun Chen, Qi‐shan Huan, Shi‐yun Tang, De‐ju Wei, Jun‐jiang Guo, Yu‐han Zhao, An‐jiang Tang
Publikováno v:
Journal of Physical Organic Chemistry. 35
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::fd3ed9f32cde17dbb9b97b871b8c7a6a
https://doi.org/10.1002/poc.4351
https://doi.org/10.1002/poc.4351
Publikováno v:
RSC advances. 11(35)
In this paper, we construct a Si
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::59e88e0b8fe843eb8726888aa739ed20
https://pubmed.ncbi.nlm.nih.gov/35478778
https://pubmed.ncbi.nlm.nih.gov/35478778