Zobrazeno 1 - 10
of 492
pro vyhledávání: '"Yi-Hong Ding"'
Publikováno v:
ACS Omega, Vol 2, Iss 9, Pp 5407-5414 (2017)
Externí odkaz:
https://doaj.org/article/551553394d144315b6618e6766412ffc
Publikováno v:
Frontiers in Chemistry, Vol 7 (2019)
Despite the great interest in energy storage application, stable neutral CnOn (n > 1) structures either in thermodynamics or kinetics have yet been largely limited due to the rather high tendency to release the very stable CO molecule. The neutral cy
Externí odkaz:
https://doaj.org/article/81f0ae9942884f1eb15eea58e1a10c87
Autor:
Xiao Tian, Yi-hong Ding
Publikováno v:
The journal of physical chemistry letters. 13(45)
Fluoronitrogens are strongly related to high-energy density materials. Fluoropentazole (
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4979771e5327fc52507d3dea39a31cfd
https://pubmed.ncbi.nlm.nih.gov/36343011
https://pubmed.ncbi.nlm.nih.gov/36343011
Publikováno v:
Nanoscale Advances. 3:4079-4088
A vital issue for the fixation and conversion of CO2 into useful chemical products is to find effective catalysts. In this work, in order to develop more effective and diverse catalysts, we implemented the first computational screening study (at M06-
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7f809321eb284fe8159768d7856165e8
https://doi.org/10.1039/d1na00150g
https://doi.org/10.1039/d1na00150g
Publikováno v:
Chemical Communications. 57:5310-5313
The more-than-one-century-old arylpentazoles can only be used in situ in generating the pentazole anion due to their unfavourable kinetic stability. We successfully increased the N2-leaving barrier to reach hitherto the highest value of 40.83 kcal mo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9d8ccb4dbd54bb654e56d525332386d1
https://doi.org/10.1039/d1cc01793d
https://doi.org/10.1039/d1cc01793d
Autor:
Tian-ding Hu, Yi-hong Ding
Publikováno v:
Organometallics. 39:505-515
It was revealed in recent experimental studies that metal–organic frameworks (MOFs) show very attractive activities for the catalytic CO2 cycloaddition with aziridines in cooperation with tetrabuty...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1f2ccfa25a35c5341af8846dc5c37232
https://doi.org/10.1021/acs.organomet.9b00657
https://doi.org/10.1021/acs.organomet.9b00657
Autor:
Gabriel Merino, Meng-hui Wang, Xue Dong, Zhong-hua Cui, Yi-hong Ding, Jorge Barroso, Mesías Orozco-Ic
Publikováno v:
Chemical Communications. 56:13772-13775
The global minimum of XMg4Y− (X = Si, Ge; Y = In, Tl) and SiMg3In2 contains a planar pentacoordinate atom of group 14 other than carbon. Its design is based on the “localization” approach, replacing one or two peripheral atoms in XMg52− by mo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::aa87a7a87b76aa7534e59bc2250fdb15
https://doi.org/10.1039/d0cc06107g
https://doi.org/10.1039/d0cc06107g
Publikováno v:
Physical Chemistry Chemical Physics. 22:26720-26727
The design and characterization of the heteronuclear group 14 C[triple bond, length as m-dash]E (E = Si, Ge, Sn, Pb) triple bonds have attracted intensive interest in the past few decades. In the current work, utilizing the advantages of N-heterocycl
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::4f4578e2fbf055bf97de338654ae25b4
https://doi.org/10.1039/d0cp02906h
https://doi.org/10.1039/d0cp02906h
Publikováno v:
RSC Advances. 10:25275-25280
For over 100 years, known bent CC compounds have been limited to those with organic (I) and all-carbon (II) scaffoldings. Here, we computationally report a novel type (III) of bent CC compound, i.e., C2Al4F6-01, which is the energetically global mini
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::56ecada8d74b3b7793c185b3a986b580
https://doi.org/10.1039/d0ra02280b
https://doi.org/10.1039/d0ra02280b
Publikováno v:
Chemical Communications. 56:7285-7288
We present a global planar pentacoordinate carbon (ppC) featuring a hitherto unreported σ–σ diradical characteristic. Using the multi-reference approach combined with the CCSD(T)/aug-cc-pVTZ method, the ppC C3Li3− was found to be an intriguing
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::205a55f5667f8dd839129b02b00a2b9e
https://doi.org/10.1039/d0cc02236e
https://doi.org/10.1039/d0cc02236e