FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2894743220> ?p ?o ?g. }

• W2894743220 abstract "Abstract It is demonstrated that there is an interconnection between surfaces, shapes, and bulk properties of macroscopic, crystalline materials. Thus, the requirement that no atom in the bulk shall experience a force from charges associated with the surface, a requirement formulated in terms of a generalized Tasker condition, leads to an interplay involving transfer of charge between different surfaces for a given sample. Through this mechanism, so‐called polar surfaces, often considered to be essentially unstable, can always be stabilized. Density functional theory slab calculations are carried out to obtain typical surface charges and associated bulk geometric displacements for an individual surface. Then the consequences of the interplay between surfaces are studied through one property that is usually considered a bulk property, namely the polarization / dipole moment per volume, and one property that is usually related to an individual surface, that is, heterogeneous catalytic activity. Model calculations illustrate the importance of charge transfer between surfaces in both cases. These calculations provide a guide for much more difficult ab initio computations that might be carried out in the future." @default.
• W2894743220 created "2018-10-12" @default.
• W2894743220 creator A5000582540 @default.
• W2894743220 creator A5002727198 @default.
• W2894743220 creator A5036908680 @default.
• W2894743220 date "2018-09-30" @default.
• W2894743220 modified "2023-09-25" @default.
• W2894743220 title "Theoretical Treatment for Properties of Surfaces and Their Interplay with Bulk Properties of Crystals" @default.
• W2894743220 cites W1109611416 @default.
• W2894743220 cites W1639852957 @default.
• W2894743220 cites W1644413525 @default.
• W2894743220 cites W1965338902 @default.
• W2894743220 cites W1974482139 @default.
• W2894743220 cites W1981368803 @default.
• W2894743220 cites W2005470678 @default.
• W2894743220 cites W2007395042 @default.
• W2894743220 cites W2011268540 @default.
• W2894743220 cites W2022900048 @default.
• W2894743220 cites W2028056984 @default.
• W2894743220 cites W2036926759 @default.
• W2894743220 cites W2043555321 @default.
• W2894743220 cites W2054225720 @default.
• W2894743220 cites W2060410316 @default.
• W2894743220 cites W2070373062 @default.
• W2894743220 cites W2071959697 @default.
• W2894743220 cites W2079105963 @default.
• W2894743220 cites W2083222334 @default.
• W2894743220 cites W2087698390 @default.
• W2894743220 cites W2087896425 @default.
• W2894743220 cites W2088899106 @default.
• W2894743220 cites W2151895170 @default.
• W2894743220 cites W2159164459 @default.
• W2894743220 cites W2613346199 @default.
• W2894743220 cites W2726959252 @default.
• W2894743220 cites W2748494387 @default.
• W2894743220 cites W2787400686 @default.
• W2894743220 cites W2804761535 @default.
• W2894743220 cites W3206606417 @default.
• W2894743220 doi "https://doi.org/10.1002/adts.201800117" @default.
• W2894743220 hasPublicationYear "2018" @default.
• W2894743220 type Work @default.
• W2894743220 sameAs 2894743220 @default.
• W2894743220 citedByCount "2" @default.
• W2894743220 countsByYear W28947432202019 @default.
• W2894743220 countsByYear W28947432202023 @default.
• W2894743220 crossrefType "journal-article" @default.
• W2894743220 hasAuthorship W2894743220A5000582540 @default.
• W2894743220 hasAuthorship W2894743220A5002727198 @default.
• W2894743220 hasAuthorship W2894743220A5036908680 @default.
• W2894743220 hasConcept C113740112 @default.
• W2894743220 hasConcept C11413529 @default.
• W2894743220 hasConcept C121332964 @default.
• W2894743220 hasConcept C147597530 @default.
• W2894743220 hasConcept C147789679 @default.
• W2894743220 hasConcept C152365726 @default.
• W2894743220 hasConcept C159467904 @default.
• W2894743220 hasConcept C173523689 @default.
• W2894743220 hasConcept C185592680 @default.
• W2894743220 hasConcept C188082385 @default.
• W2894743220 hasConcept C192562407 @default.
• W2894743220 hasConcept C205049153 @default.
• W2894743220 hasConcept C2524010 @default.
• W2894743220 hasConcept C26873012 @default.
• W2894743220 hasConcept C2776799497 @default.
• W2894743220 hasConcept C2781442258 @default.
• W2894743220 hasConcept C33923547 @default.
• W2894743220 hasConcept C45374587 @default.
• W2894743220 hasConcept C62520636 @default.
• W2894743220 hasConcept C8058405 @default.
• W2894743220 hasConceptScore W2894743220C113740112 @default.
• W2894743220 hasConceptScore W2894743220C11413529 @default.
• W2894743220 hasConceptScore W2894743220C121332964 @default.
• W2894743220 hasConceptScore W2894743220C147597530 @default.
• W2894743220 hasConceptScore W2894743220C147789679 @default.
• W2894743220 hasConceptScore W2894743220C152365726 @default.
• W2894743220 hasConceptScore W2894743220C159467904 @default.
• W2894743220 hasConceptScore W2894743220C173523689 @default.
• W2894743220 hasConceptScore W2894743220C185592680 @default.
• W2894743220 hasConceptScore W2894743220C188082385 @default.
• W2894743220 hasConceptScore W2894743220C192562407 @default.
• W2894743220 hasConceptScore W2894743220C205049153 @default.
• W2894743220 hasConceptScore W2894743220C2524010 @default.
• W2894743220 hasConceptScore W2894743220C26873012 @default.
• W2894743220 hasConceptScore W2894743220C2776799497 @default.
• W2894743220 hasConceptScore W2894743220C2781442258 @default.
• W2894743220 hasConceptScore W2894743220C33923547 @default.
• W2894743220 hasConceptScore W2894743220C45374587 @default.
• W2894743220 hasConceptScore W2894743220C62520636 @default.
• W2894743220 hasConceptScore W2894743220C8058405 @default.
• W2894743220 hasFunder F4320320879 @default.
• W2894743220 hasIssue "2" @default.
• W2894743220 hasLocation W28947432201 @default.
• W2894743220 hasOpenAccess W2894743220 @default.
• W2894743220 hasPrimaryLocation W28947432201 @default.
• W2894743220 hasRelatedWork W1963611537 @default.
• W2894743220 hasRelatedWork W1992268193 @default.
• W2894743220 hasRelatedWork W2002561246 @default.
• W2894743220 hasRelatedWork W2007407272 @default.
• W2894743220 hasRelatedWork W2035087097 @default.
• W2894743220 hasRelatedWork W2066711016 @default.

• next