Matches in SemOpenAlex for { <https://semopenalex.org/work/W2778296464> ?p ?o ?g. }
- W2778296464 endingPage "1408" @default.
- W2778296464 startingPage "1401" @default.
- W2778296464 abstract "We unravel the origin of the recently observed striking enantioselectivity of the PdGa(111) surface with respect to the adsorption of a small organic molecule, 9-ethynylphenanthrene, using first-principles calculations. It turns out that the key ingredient to understand the experimental evidence is the appropriate description of van der Waals interactions beyond the widely employed atomic pairwise approximation. A recently developed van der Waals-inclusive density functional method, which encompasses dielectric screening effects, reveals the origin of the experimentally observed enantioselectivity and provides conclusive evidence of chiral recognition on a bimetallic surface driven by dispersion interactions. The incorporation of dielectric screening leads to a renormalization of the dispersion interaction range, allowing for the appropriate weighting of the molecule–substrate interactions at intermediate distances between 2.5 and 5 Å. Our findings have implications for the structure and stability of complex organic/inorganic systems where dielectric screening effects are expected to be of general importance." @default.
- W2778296464 created "2018-01-05" @default.
- W2778296464 creator A5010495830 @default.
- W2778296464 creator A5026929463 @default.
- W2778296464 creator A5056608821 @default.
- W2778296464 creator A5056779247 @default.
- W2778296464 creator A5083928873 @default.
- W2778296464 date "2018-01-19" @default.
- W2778296464 modified "2023-09-23" @default.
- W2778296464 title "Hidden Beneath the Surface: Origin of the Observed Enantioselective Adsorption on PdGa(111)" @default.
- W2778296464 cites W1810694562 @default.
- W2778296464 cites W1965718782 @default.
- W2778296464 cites W1970623278 @default.
- W2778296464 cites W1981368803 @default.
- W2778296464 cites W1985118658 @default.
- W2778296464 cites W1986436630 @default.
- W2778296464 cites W1986528235 @default.
- W2778296464 cites W1997330539 @default.
- W2778296464 cites W1997898286 @default.
- W2778296464 cites W2000785796 @default.
- W2778296464 cites W2012817868 @default.
- W2778296464 cites W2014166972 @default.
- W2778296464 cites W2020072134 @default.
- W2778296464 cites W2030976617 @default.
- W2778296464 cites W2034275169 @default.
- W2778296464 cites W2040846037 @default.
- W2778296464 cites W2041694664 @default.
- W2778296464 cites W2041848502 @default.
- W2778296464 cites W2044100255 @default.
- W2778296464 cites W2044591029 @default.
- W2778296464 cites W2047524879 @default.
- W2778296464 cites W2051700545 @default.
- W2778296464 cites W2059109129 @default.
- W2778296464 cites W2059885388 @default.
- W2778296464 cites W2063482580 @default.
- W2778296464 cites W2066951434 @default.
- W2778296464 cites W2070116103 @default.
- W2778296464 cites W2092157292 @default.
- W2778296464 cites W2095297942 @default.
- W2778296464 cites W2106529816 @default.
- W2778296464 cites W2111533539 @default.
- W2778296464 cites W2112663587 @default.
- W2778296464 cites W2112850441 @default.
- W2778296464 cites W2122427541 @default.
- W2778296464 cites W2141068582 @default.
- W2778296464 cites W2145161566 @default.
- W2778296464 cites W2147625913 @default.
- W2778296464 cites W2148424525 @default.
- W2778296464 cites W2148678374 @default.
- W2778296464 cites W2149655632 @default.
- W2778296464 cites W2157886206 @default.
- W2778296464 cites W2158043072 @default.
- W2778296464 cites W2230728100 @default.
- W2778296464 cites W2263300508 @default.
- W2778296464 cites W2322479756 @default.
- W2778296464 cites W2328928309 @default.
- W2778296464 cites W2403404540 @default.
- W2778296464 cites W2507385827 @default.
- W2778296464 cites W2567116659 @default.
- W2778296464 cites W2586107431 @default.
- W2778296464 cites W2594341860 @default.
- W2778296464 cites W2618459703 @default.
- W2778296464 cites W2620747940 @default.
- W2778296464 cites W3102994515 @default.
- W2778296464 cites W4239793017 @default.
- W2778296464 doi "https://doi.org/10.1021/jacs.7b10980" @default.
- W2778296464 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/29283567" @default.
- W2778296464 hasPublicationYear "2018" @default.
- W2778296464 type Work @default.
- W2778296464 sameAs 2778296464 @default.
- W2778296464 citedByCount "13" @default.
- W2778296464 countsByYear W27782964642019 @default.
- W2778296464 countsByYear W27782964642020 @default.
- W2778296464 countsByYear W27782964642021 @default.
- W2778296464 countsByYear W27782964642022 @default.
- W2778296464 countsByYear W27782964642023 @default.
- W2778296464 crossrefType "journal-article" @default.
- W2778296464 hasAuthorship W2778296464A5010495830 @default.
- W2778296464 hasAuthorship W2778296464A5026929463 @default.
- W2778296464 hasAuthorship W2778296464A5056608821 @default.
- W2778296464 hasAuthorship W2778296464A5056779247 @default.
- W2778296464 hasAuthorship W2778296464A5083928873 @default.
- W2778296464 hasBestOaLocation W27782964642 @default.
- W2778296464 hasConcept C121332964 @default.
- W2778296464 hasConcept C126061179 @default.
- W2778296464 hasConcept C133386390 @default.
- W2778296464 hasConcept C147597530 @default.
- W2778296464 hasConcept C147789679 @default.
- W2778296464 hasConcept C150394285 @default.
- W2778296464 hasConcept C152365726 @default.
- W2778296464 hasConcept C159467904 @default.
- W2778296464 hasConcept C161790260 @default.
- W2778296464 hasConcept C177562468 @default.
- W2778296464 hasConcept C178790620 @default.
- W2778296464 hasConcept C185592680 @default.
- W2778296464 hasConcept C32909587 @default.
- W2778296464 hasConcept C43411465 @default.
- W2778296464 hasConcept C62520636 @default.