Zobrazeno 1 - 7
of 7
pro vyhledávání: '"ANNA TACONI"'
Publikováno v:
Proposed for presentation at the International MACCS User Group in.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e60342409a813ae749fa3d16679fe163
https://doi.org/10.2172/1888451
https://doi.org/10.2172/1888451
Publikováno v:
Catalysis Science & Technology. 8:4083-4096
Catalytic hydrodeoxygenation (HDO) of phenolics is a necessary step for upgrading bio-oils to transportation fuels. Bimetallic catalysts offer the potential of increased activities and selectivities for desired products. Adding non-metallic elements,
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2448cbd8cf4a284f67f8e2a94a894066
https://doi.org/10.1039/c8cy00977e
https://doi.org/10.1039/c8cy00977e
Publikováno v:
The Journal of Chemical Physics. 148:224501
Predicting vapor liquid equilibria (VLE) of molecules governed by weak van der Waals (vdW) interactions using the first principles approach is a significant challenge. Due to the poor scaling of the post Hartree-Fock wave function theory with system
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e5bb514abca7e61173d85a60df7ce886
https://doi.org/10.1063/1.5025726
https://doi.org/10.1063/1.5025726