FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2058025717> ?p ?o ?g. }

• W2058025717 abstract "Abstract The atomic relaxation of the nonpolar (1010) surface of BeO has been calculated by minimizing the surface energy within the framework of the ab initio Hartree-Fock method. A six-layer two-dimensionally periodic slab model was used, permitting a full symmetry-conserving relaxation of the two outer layers. The BeO surface bonds show a small rotation angle of about 4 accompanied by a large (about 10%) reduction in surface bond length. Significant contraction of backbonds and a small rotation of second layer bonds are also found. The relaxed BeO (1010) surface is thus predicted to be similar to the ZnO (1010) surface but different from the corresponding surfaces of all other II–VI compounds. Various explanations for this difference are discussed, and evidence from a bond population analysis is presented which suggests that this behavior can be described in terms of partial double bond character in the surface bonds. Since multiple bonding is related to small atomic radii, it would follow that the small radius of the oxygen atom is the ultimate cause of the type of surface relaxation we predict." @default.
• W2058025717 created "2016-06-24" @default.
• W2058025717 creator A5004682395 @default.
• W2058025717 creator A5014585812 @default.
• W2058025717 date "1997-06-01" @default.
• W2058025717 modified "2023-09-27" @default.
• W2058025717 title "Atomic relaxation of the BeO (101̄0) surface" @default.
• W2058025717 cites W1963584577 @default.
• W2058025717 cites W2023944346 @default.
• W2058025717 cites W2026293635 @default.
• W2058025717 cites W2028925392 @default.
• W2058025717 cites W2031836087 @default.
• W2058025717 cites W2033562674 @default.
• W2058025717 cites W2069431636 @default.
• W2058025717 cites W2076116294 @default.
• W2058025717 cites W2089582286 @default.
• W2058025717 cites W560933868 @default.
• W2058025717 doi "https://doi.org/10.1016/s0039-6028(97)00059-9" @default.
• W2058025717 hasPublicationYear "1997" @default.
• W2058025717 type Work @default.
• W2058025717 sameAs 2058025717 @default.
• W2058025717 citedByCount "10" @default.
• W2058025717 countsByYear W20580257172015 @default.
• W2058025717 countsByYear W20580257172021 @default.
• W2058025717 crossrefType "journal-article" @default.
• W2058025717 hasAuthorship W2058025717A5004682395 @default.
• W2058025717 hasAuthorship W2058025717A5014585812 @default.
• W2058025717 hasConcept C115624301 @default.
• W2058025717 hasConcept C121332964 @default.
• W2058025717 hasConcept C122032599 @default.
• W2058025717 hasConcept C144024400 @default.
• W2058025717 hasConcept C149635348 @default.
• W2058025717 hasConcept C149923435 @default.
• W2058025717 hasConcept C155860418 @default.
• W2058025717 hasConcept C15744967 @default.
• W2058025717 hasConcept C178635117 @default.
• W2058025717 hasConcept C178790620 @default.
• W2058025717 hasConcept C184779094 @default.
• W2058025717 hasConcept C185592680 @default.
• W2058025717 hasConcept C2524010 @default.
• W2058025717 hasConcept C2776029896 @default.
• W2058025717 hasConcept C2776799497 @default.
• W2058025717 hasConcept C2781442258 @default.
• W2058025717 hasConcept C2908647359 @default.
• W2058025717 hasConcept C32909587 @default.
• W2058025717 hasConcept C33923547 @default.
• W2058025717 hasConcept C38652104 @default.
• W2058025717 hasConcept C41008148 @default.
• W2058025717 hasConcept C41999313 @default.
• W2058025717 hasConcept C58312451 @default.
• W2058025717 hasConcept C71100877 @default.
• W2058025717 hasConcept C77805123 @default.
• W2058025717 hasConcept C8010536 @default.
• W2058025717 hasConceptScore W2058025717C115624301 @default.
• W2058025717 hasConceptScore W2058025717C121332964 @default.
• W2058025717 hasConceptScore W2058025717C122032599 @default.
• W2058025717 hasConceptScore W2058025717C144024400 @default.
• W2058025717 hasConceptScore W2058025717C149635348 @default.
• W2058025717 hasConceptScore W2058025717C149923435 @default.
• W2058025717 hasConceptScore W2058025717C155860418 @default.
• W2058025717 hasConceptScore W2058025717C15744967 @default.
• W2058025717 hasConceptScore W2058025717C178635117 @default.
• W2058025717 hasConceptScore W2058025717C178790620 @default.
• W2058025717 hasConceptScore W2058025717C184779094 @default.
• W2058025717 hasConceptScore W2058025717C185592680 @default.
• W2058025717 hasConceptScore W2058025717C2524010 @default.
• W2058025717 hasConceptScore W2058025717C2776029896 @default.
• W2058025717 hasConceptScore W2058025717C2776799497 @default.
• W2058025717 hasConceptScore W2058025717C2781442258 @default.
• W2058025717 hasConceptScore W2058025717C2908647359 @default.
• W2058025717 hasConceptScore W2058025717C32909587 @default.
• W2058025717 hasConceptScore W2058025717C33923547 @default.
• W2058025717 hasConceptScore W2058025717C38652104 @default.
• W2058025717 hasConceptScore W2058025717C41008148 @default.
• W2058025717 hasConceptScore W2058025717C41999313 @default.
• W2058025717 hasConceptScore W2058025717C58312451 @default.
• W2058025717 hasConceptScore W2058025717C71100877 @default.
• W2058025717 hasConceptScore W2058025717C77805123 @default.
• W2058025717 hasConceptScore W2058025717C8010536 @default.
• W2058025717 hasLocation W20580257171 @default.
• W2058025717 hasOpenAccess W2058025717 @default.
• W2058025717 hasPrimaryLocation W20580257171 @default.
• W2058025717 hasRelatedWork W1527209856 @default.
• W2058025717 hasRelatedWork W1973917612 @default.
• W2058025717 hasRelatedWork W1976863395 @default.
• W2058025717 hasRelatedWork W1980438166 @default.
• W2058025717 hasRelatedWork W1993175119 @default.
• W2058025717 hasRelatedWork W2026484822 @default.
• W2058025717 hasRelatedWork W2026987930 @default.
• W2058025717 hasRelatedWork W2036519370 @default.
• W2058025717 hasRelatedWork W2051280692 @default.
• W2058025717 hasRelatedWork W2062293473 @default.
• W2058025717 hasRelatedWork W2067393687 @default.
• W2058025717 hasRelatedWork W2080823962 @default.
• W2058025717 hasRelatedWork W2082209538 @default.
• W2058025717 hasRelatedWork W2084747390 @default.
• W2058025717 hasRelatedWork W2095079049 @default.
• W2058025717 hasRelatedWork W2147989394 @default.
• W2058025717 hasRelatedWork W2156043072 @default.
• W2058025717 hasRelatedWork W2335171542 @default.

• next