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WFRF:(Pell Andrew J.)
 

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LIBRIS Formathandbok  (Information om MARC21)
FältnamnIndikatorerMetadata
00003642naa a2200505 4500
001oai:DiVA.org:su-197145
003SwePub
008210927s2021 | |||||||||||000 ||eng|
024a https://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-1971452 URI
024a https://doi.org/10.1038/s41467-021-24589-52 DOI
040 a (SwePub)su
041 a engb eng
042 9 SwePub
072 7a ref2 swepub-contenttype
072 7a art2 swepub-publicationtype
100a Papawassiliou, Wassiliosu Stockholms universitet,Institutionen för material- och miljökemi (MMK)4 aut0 (Swepub:su)wpapa
2451 0a Crystal and electronic facet analysis of ultrafine Ni2P particles by solid-state NMR nanocrystallography
264 c 2021-07-15
264 1b Springer Science and Business Media LLC,c 2021
338 a print2 rdacarrier
520 a Structural and morphological control of crystalline nanoparticles is crucial in the field of heterogeneous catalysis and the development of reaction specific catalysts. To achieve this, colloidal chemistry methods are combined with ab initio calculations in order to define the reaction parameters, which drive chemical reactions to the desired crystal nucleation and growth path. Key in this procedure is the experimental verification of the predicted crystal facets and their corresponding electronic structure, which in case of nanostructured materials becomes extremely difficult. Here, by employing P-31 solid-state nuclear magnetic resonance aided by advanced density functional theory calculations to obtain and assign the Knight shifts, we succeed in determining the crystal and electronic structure of the terminating surfaces of ultrafine Ni2P nanoparticles at atomic scale resolution. Our work highlights the potential of ssNMR nanocrystallography as a unique tool in the emerging field of facet-engineered nanocatalysts. Structural and morphological control of crystalline nanoparticles is crucial in heterogeneous catalysis. Applying DFT-assisted solid-state NMR spectroscopy, we determine the surface crystal and electronic structure of Ni2P nanoparticles, unveiling NMR nanocrystallography as an emerging tool in facet-engineered nanocatalysts.
650 7a NATURVETENSKAPx Kemi0 (SwePub)1042 hsv//swe
650 7a NATURAL SCIENCESx Chemical Sciences0 (SwePub)1042 hsv//eng
700a Carvalho, José P.u Stockholms universitet,Institutionen för material- och miljökemi (MMK)4 aut0 (Swepub:su)joal7751
700a Panopoulos, Nikolaos4 aut
700a Al Wahedi, Yasser4 aut
700a Shankarayya Wadi, Vijay Kumar4 aut
700a Lu, Xinnan4 aut
700a Polychronopoulou, Kyriaki4 aut
700a Lee, Jin Bae4 aut
700a Lee, Sanggil4 aut
700a Kim, Chang Yeon4 aut
700a Kim, Hae Jin4 aut
700a Katsiotis, Marios4 aut
700a Tzitzios, Vasileios4 aut
700a Karagianni, Marina4 aut
700a Fardis, Michael4 aut
700a Papavassiliou, Georgios4 aut
700a Pell, Andrew J.u Stockholms universitet,Institutionen för material- och miljökemi (MMK),Université de Lyon, France4 aut0 (Swepub:su)apell
710a Stockholms universitetb Institutionen för material- och miljökemi (MMK)4 org
773t Nature Communicationsd : Springer Science and Business Media LLCg 12:1q 12:1x 2041-1723
856u https://doi.org/10.1038/s41467-021-24589-5y Fulltext
856u https://www.nature.com/articles/s41467-021-24589-5.pdf
8564 8u https://urn.kb.se/resolve?urn=urn:nbn:se:su:diva-197145
8564 8u https://doi.org/10.1038/s41467-021-24589-5

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