Zobrazeno 1 - 6
of 6
pro vyhledávání: '"Yong Su Baek"'
Publikováno v:
Physical Chemistry Chemical Physics. 23:8368-8374
Oxidative-denitrogenation (ODN) of indole (IND) and methyl-substituted INDs (methyl-INDs), representative neutral nitrogen-containing compounds (NCCs), was carried out with TiO2@C and H2O2 as heterogeneous catalyst and oxidant, respectively, under ul
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a02af34aa05c8b95f9ad85a351009112
https://doi.org/10.1039/d1cp00633a
https://doi.org/10.1039/d1cp00633a
Publikováno v:
Physical chemistry chemical physics : PCCP. 23(14)
Oxidative-denitrogenation (ODN) of indole (IND) and methyl-substituted INDs (methyl-INDs), representative neutral nitrogen-containing compounds (NCCs), was carried out with TiO
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::3166626936cf80799c5cb3fb264beaf5
https://pubmed.ncbi.nlm.nih.gov/33876001
https://pubmed.ncbi.nlm.nih.gov/33876001
Publikováno v:
The journal of physical chemistry. A. 125(9)
A new adaptive algorithm for penalty function optimization for minimum-energy three-states conical intersections (ME3CI) is suggested. The new algorithm differs from the original penalty function algorithm by (a) removing the redundancy in the target
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4b2bf609ba396b69e14990aff31db43e
https://pubmed.ncbi.nlm.nih.gov/33651623
https://pubmed.ncbi.nlm.nih.gov/33651623
Autor:
Dae Wi Min, Yong Su Baek, Bo-Mi Kim, Wonyong Choi, Kitae Kim, Cheol Ho Choi, Alfonso Saiz-Lopez
Publikováno v:
Digital.CSIC. Repositorio Institucional del CSIC
instname
instname
4 pags., 3 figs.
Ice-core records show that anthropogenic pollution has increased the global atmospheric concentrations of hydrogen peroxide and iodine since the mid-20th century. Here, for the first time, we demonstrate a highly efficient mecha
Ice-core records show that anthropogenic pollution has increased the global atmospheric concentrations of hydrogen peroxide and iodine since the mid-20th century. Here, for the first time, we demonstrate a highly efficient mecha
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4318ff129af15ff433363bba45b05fa0
http://hdl.handle.net/10261/228859
http://hdl.handle.net/10261/228859
Autor:
Cheol Ho Choi, Yong Su Baek
Publikováno v:
Journal of Chemical Theory and Computation. 14:2312-2321
A one-dimensional projection (ODP) technique is introduced to overcome the challenges in multidimensional sampling. With the help of a projected "advancement of reaction (ξ)" control parameter, it was demonstrated that multidimensional samplings cou
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9dde4e5f4ea5a53d1f74891c00a2fb1c
https://doi.org/10.1021/acs.jctc.7b01139
https://doi.org/10.1021/acs.jctc.7b01139
Publikováno v:
Applied Catalysis B: Environmental. 285:119842
Tungsten nitride-incorporated carbon (W2N(x)@C) was firstly prepared via pyrolysis of a newly developed phosphotungstic acid-loaded metal-azolate framework-6, PTA(x)@MAF-6 s. The obtained (without ammonia feeding) W2N(x)@C materials, were utilized as
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7c4452a49a5700a5913407d6c56664b2
https://doi.org/10.1016/j.apcatb.2020.119842
https://doi.org/10.1016/j.apcatb.2020.119842