FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W4313595789> ?p ?o ?g. }

• W4313595789 endingPage "941" @default.
• W4313595789 startingPage "930" @default.
• W4313595789 abstract "Electrochemical CO2 reduction to transportation fuels and valuable platform chemicals provides a sustainable avenue for renewable energy storage and realizes an artificially closed carbon loop. However, the rational design of highly active and selective CO2 reduction electrocatalysts remains a challenging task. Herein, a series of metal-organic framework (MOF)-supported flexible, self-adaptive dual-metal-site pairs (DMSPs) including 21 pairwise combinations of six transition metal single sites (MOF-808-EDTA-M1M2, M1/M2 = Fe, Cu, Ni, Pd, Pt, Au) for the CO2 reduction reaction (CO2RR) were theoretically screened using density functional theory calculations. Against the competitive hydrogen evolution reaction, MOF-808-EDTA-FeFe and MOF-808-EDTA-FePt were identified as the promising CO2RR electrocatalysts toward C1 and C2 products. The calculated limiting potential for CO2 electroreduction to C2H6 and C2H5OH over MOF-808-EDTA-FeFe is -0.87 V. Compared with an applied potential of -0.56 eV toward CH4 production over MOF-808-EDTA-FeFe, MOF-808-EDTA-FePt exhibits an even better activity for CO2 reduction to C1 products at a limiting potential of -0.35 V. The present work not only identifies promising candidates for highly selective CO2RR electrocatalysts leading to C1 and C2 products but also provides mechanistic insights into the dynamic nature of DMSPs for stabilizing various reaction intermediates in the CO2RR process." @default.
• W4313595789 created "2023-01-06" @default.
• W4313595789 creator A5035752959 @default.
• W4313595789 creator A5051658453 @default.
• W4313595789 creator A5052600714 @default.
• W4313595789 creator A5052883326 @default.
• W4313595789 creator A5074677660 @default.
• W4313595789 date "2023-01-06" @default.
• W4313595789 modified "2023-10-06" @default.
• W4313595789 title "Theoretical Screening of CO₂ Electroreduction over MOF-808-Supported Self-Adaptive Dual-Metal-Site Pairs" @default.
• W4313595789 cites W1976002844 @default.
• W4313595789 cites W1981368803 @default.
• W4313595789 cites W1982153238 @default.
• W4313595789 cites W1982952953 @default.
• W4313595789 cites W1989060947 @default.
• W4313595789 cites W2000770615 @default.
• W4313595789 cites W2014166972 @default.
• W4313595789 cites W2023166289 @default.
• W4313595789 cites W2053030648 @default.
• W4313595789 cites W2060023027 @default.
• W4313595789 cites W2092157292 @default.
• W4313595789 cites W2107748559 @default.
• W4313595789 cites W2112307556 @default.
• W4313595789 cites W2141939342 @default.
• W4313595789 cites W2163242195 @default.
• W4313595789 cites W2167035995 @default.
• W4313595789 cites W2246944211 @default.
• W4313595789 cites W2340533519 @default.
• W4313595789 cites W2560832335 @default.
• W4313595789 cites W2586677999 @default.
• W4313595789 cites W2591654700 @default.
• W4313595789 cites W2599278685 @default.
• W4313595789 cites W2736252341 @default.
• W4313595789 cites W2803362190 @default.
• W4313595789 cites W2883018259 @default.
• W4313595789 cites W2897574808 @default.
• W4313595789 cites W2903681646 @default.
• W4313595789 cites W2933816311 @default.
• W4313595789 cites W2935756882 @default.
• W4313595789 cites W2942998504 @default.
• W4313595789 cites W2944826525 @default.
• W4313595789 cites W2954103758 @default.
• W4313595789 cites W2954591269 @default.
• W4313595789 cites W2954959763 @default.
• W4313595789 cites W2955675264 @default.
• W4313595789 cites W2957195252 @default.
• W4313595789 cites W2972593701 @default.
• W4313595789 cites W2996484722 @default.
• W4313595789 cites W2999712458 @default.
• W4313595789 cites W3005711490 @default.
• W4313595789 cites W3011252584 @default.
• W4313595789 cites W3012252546 @default.
• W4313595789 cites W3017217753 @default.
• W4313595789 cites W3024567892 @default.
• W4313595789 cites W3027308092 @default.
• W4313595789 cites W3102306075 @default.
• W4313595789 cites W3122868307 @default.
• W4313595789 cites W3135562722 @default.
• W4313595789 cites W3153536202 @default.
• W4313595789 cites W3195258996 @default.
• W4313595789 cites W3196218432 @default.
• W4313595789 cites W4226218155 @default.
• W4313595789 cites W4229013726 @default.
• W4313595789 cites W4281782708 @default.
• W4313595789 doi "https://doi.org/10.1021/acs.inorgchem.2c03734" @default.
• W4313595789 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/36607142" @default.
• W4313595789 hasPublicationYear "2023" @default.
• W4313595789 type Work @default.
• W4313595789 citedByCount "1" @default.
• W4313595789 countsByYear W43135957892023 @default.
• W4313595789 crossrefType "journal-article" @default.
• W4313595789 hasAuthorship W4313595789A5035752959 @default.
• W4313595789 hasAuthorship W4313595789A5051658453 @default.
• W4313595789 hasAuthorship W4313595789A5052600714 @default.
• W4313595789 hasAuthorship W4313595789A5052883326 @default.
• W4313595789 hasAuthorship W4313595789A5074677660 @default.
• W4313595789 hasConcept C106773901 @default.
• W4313595789 hasConcept C127413603 @default.
• W4313595789 hasConcept C147597530 @default.
• W4313595789 hasConcept C147789679 @default.
• W4313595789 hasConcept C150394285 @default.
• W4313595789 hasConcept C152365726 @default.
• W4313595789 hasConcept C161790260 @default.
• W4313595789 hasConcept C17525397 @default.
• W4313595789 hasConcept C178790620 @default.
• W4313595789 hasConcept C179104552 @default.
• W4313595789 hasConcept C179366358 @default.
• W4313595789 hasConcept C185592680 @default.
• W4313595789 hasConcept C188198153 @default.
• W4313595789 hasConcept C21951064 @default.
• W4313595789 hasConcept C52859227 @default.
• W4313595789 hasConcept C544153396 @default.
• W4313595789 hasConcept C55904794 @default.
• W4313595789 hasConcept C78519656 @default.
• W4313595789 hasConceptScore W4313595789C106773901 @default.
• W4313595789 hasConceptScore W4313595789C127413603 @default.
• W4313595789 hasConceptScore W4313595789C147597530 @default.
• W4313595789 hasConceptScore W4313595789C147789679 @default.

• next