Zobrazeno 1 - 10
of 14
pro vyhledávání: '"Victor Posligua"'
Autor:
Chiara Genovese, Manfred E. Schuster, Emma K. Gibson, Diego Gianolio, Victor Posligua, Ricardo Grau-Crespo, Giannantonio Cibin, Peter P. Wells, Debi Garai, Vladyslav Solokha, Sandra Krick Calderon, Juan J. Velasco-Velez, Claudio Ampelli, Siglinda Perathoner, Georg Held, Gabriele Centi, Rosa Arrigo
Publikováno v:
Nature Communications, Vol 9, Iss 1, Pp 1-12 (2018)
Trapping carbon dioxide within usable chemicals is a promising means to mitigate climate change, yet electrochemical C–C couplings are challenging to perform. Here, the authors prepared iron oxyhydroxides on nitrogen-doped carbon that efficiently c
Externí odkaz:
https://doaj.org/article/9424b3e622db4ecfbed471564f724d99
Autor:
Jose J. Plata, Victor Posligua, Antonio M. Márquez, Javier Fernandez Sanz, Ricardo Grau-Crespo
Publikováno v:
Chemistry of Materials. 34:2833-2841
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f20c21f01e52498731139fe8b62f3c0c
https://doi.org/10.1021/acs.chemmater.2c00336
https://doi.org/10.1021/acs.chemmater.2c00336
Autor:
Ru-Jin Li, Andrew Tarzia, Victor Posligua, Kim E. Jelfs, Nicolas Sanchez, Adam Marcus, Ananya Baksi, Guido H. Clever, Farzaneh Fadaei-Tirani, Kay Severin
Publikováno v:
Chemical science. 13(40)
Cuboctahedral coordination cages of the general formula [Pd12L24]24+ (L = low-symmetry ligand) were analyzed theoretically and experimentally. With 350 696 potential isomers, the structural space of these assemblies is vast. Orientational self-sortin
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8aba175b8fa4443d674dfd7d2a932b16
https://pubmed.ncbi.nlm.nih.gov/36320919
https://pubmed.ncbi.nlm.nih.gov/36320919
The use of computer simulation to predict the lattice thermal conductivity of materials has the potential to accelerate the discovery of new thermoelectric materials. However, the accurate prediction of this property from first principles, without in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::c4f79e720874a0cefb67b6cecb1e6b56
https://doi.org/10.26434/chemrxiv-2021-dj90x
https://doi.org/10.26434/chemrxiv-2021-dj90x
Autor:
Javier Fernández Sanz, Jose J. Plata, Victor Posligua, Antonio Joaquín Santos Márquez, Ricardo Grau-Crespo
The use of computer simulation to predict the lattice thermal conductivity of materials has the potential to accelerate the discovery of new thermoelectric materials. However, the accurate prediction of this property from first principles, without in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::15ee5c06a32aa543d65ab894ddcfd6e7
https://doi.org/10.33774/chemrxiv-2021-dj90x
https://doi.org/10.33774/chemrxiv-2021-dj90x
Autor:
Peter J. F. Harris, Joana Bustamante, Ricardo Grau-Crespo, Cesar H. Zambrano, Victor Posligua
Publikováno v:
RSC advances. 10(13)
The properties of graphite, and of few-layer graphene, can be strongly influenced by the edge structure of the graphene planes, but there is still much that we do not understand about the geometry and stability of these edges. We present an experimen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a4a9c74733626109c7c081eb1bc3cbab
https://pubmed.ncbi.nlm.nih.gov/35492145
https://pubmed.ncbi.nlm.nih.gov/35492145
Autor:
Alex Aziz, Victor Posligua, Miguel Rivera, Rachel Crespo-Otero, Dimpy Pandya, Said Hamad, Ricardo Grau-Crespo
Publikováno v:
Journal of Physics: Energy. 3:034005
Metal-organic frameworks (MOFs) are promising photocatalytic materials due to their high surface area and tuneability of their electronic structure. We discuss here how to engineer the band structures and optical properties of a family of two-dimensi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::01d9c6986de18f7fc0af05989038c3fd
https://doi.org/10.1088/2515-7655/abeab4
https://doi.org/10.1088/2515-7655/abeab4
Autor:
Jean-Christophe Soetens, Miguel Angel Mendez, Victor Posligua, Cesar H. Zambrano, F.J. Torres, Luis Rincón, Andres S. Urbina
Publikováno v:
Computational and Theoretical Chemistry. 1073:75-83
In the present study, a theoretical investigation of the potential of various metal-functionalized R-substituted pyrogallol[4]arenes (i.e., M-R-Pyg[4]arene; M = Li+, K+, Na+ and Mg2+; R = methyl and fluoroethyl) as media for molecular hydrogen (H2) s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::25054a29936eb63185e46dc2e7b586c6
https://doi.org/10.1016/j.comptc.2015.08.017
https://doi.org/10.1016/j.comptc.2015.08.017
Autor:
Rosa Arrigo, Debi Garai, Claudio Ampelli, Peter P. Wells, Ricardo Grau-Crespo, Gabriele Centi, Georg Held, Chiara Genovese, Giannantonio Cibin, Diego Gianolio, Vladyslav Solokha, Sandra Krick Calderon, Juan J. Velasco-Vélez, Victor Posligua, Manfred Erwin Schuster, Siglinda Perathoner, Emma K. Gibson
Publikováno v:
Nature Communications
Nature Communications, Vol 9, Iss 1, Pp 1-12 (2018)
Nature Communications, Vol 9, Iss 1, Pp 1-12 (2018)
The carbon–carbon coupling via electrochemical reduction of carbon dioxide represents the biggest challenge for using this route as platform for chemicals synthesis. Here we show that nanostructured iron (III) oxyhydroxide on nitrogen-doped carbon
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5f291a83599cf654d3fd988a43fa6710
http://europepmc.org/articles/PMC5838105
http://europepmc.org/articles/PMC5838105
Autor:
Renée Haver, Victor Posligua, Harry L. Anderson, Alex Aziz, Ricardo Grau-Crespo, Martin D. Peeks
Recent progress in the synthesis of π-conjugated porphyrin arrays of different shapes and dimensionalities motivates us to examine the band structures of infinite (periodic) porphyrin nanostructures. We use screened hybrid density functional theory
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::30f0b1ce091db93f8ce38457edbf7f33
https://centaur.reading.ac.uk/79879/4/accepted-manuscript.pdf
https://centaur.reading.ac.uk/79879/4/accepted-manuscript.pdf