Matches in SemOpenAlex for { <https://semopenalex.org/work/W1979290400> ?p ?o ?g. }
Showing items 1 to 96 of
96
with 100 items per page.
- W1979290400 endingPage "33" @default.
- W1979290400 startingPage "27" @default.
- W1979290400 abstract "The adsorption of thiophene on the (1 0 0) surface of nickel has been studied using ab initio local-density-functional calculations. Our technique is based on PAW-potentials, residuum minimization techniques for the calculation of the electronic ground state and of the Hellmann–Feynman forces, and on a conjugate-gradient technique for the optimization of the atomic structure. On the Ni(1 0 0) surface the adsorption leads to a strong chemisorption of the molecule and a disruption of the aromatic ring." @default.
- W1979290400 created "2016-06-24" @default.
- W1979290400 creator A5010335715 @default.
- W1979290400 creator A5090003078 @default.
- W1979290400 date "2001-10-01" @default.
- W1979290400 modified "2023-09-25" @default.
- W1979290400 title "A DFT study of the adsorption of thiophene on Ni(100)" @default.
- W1979290400 cites W1970127494 @default.
- W1979290400 cites W1976130548 @default.
- W1979290400 cites W1979544533 @default.
- W1979290400 cites W1985776065 @default.
- W1979290400 cites W1991037743 @default.
- W1979290400 cites W1991971167 @default.
- W1979290400 cites W1994589203 @default.
- W1979290400 cites W2003998499 @default.
- W1979290400 cites W2004821594 @default.
- W1979290400 cites W2007395042 @default.
- W1979290400 cites W2022791515 @default.
- W1979290400 cites W2036113194 @default.
- W1979290400 cites W2038583777 @default.
- W1979290400 cites W2048110449 @default.
- W1979290400 cites W2064807075 @default.
- W1979290400 cites W2070233382 @default.
- W1979290400 cites W2072745289 @default.
- W1979290400 cites W2079105963 @default.
- W1979290400 cites W2093914988 @default.
- W1979290400 cites W2172086327 @default.
- W1979290400 cites W3206606417 @default.
- W1979290400 doi "https://doi.org/10.1016/s0039-6028(01)01424-8" @default.
- W1979290400 hasPublicationYear "2001" @default.
- W1979290400 type Work @default.
- W1979290400 sameAs 1979290400 @default.
- W1979290400 citedByCount "35" @default.
- W1979290400 countsByYear W19792904002012 @default.
- W1979290400 countsByYear W19792904002013 @default.
- W1979290400 countsByYear W19792904002014 @default.
- W1979290400 countsByYear W19792904002015 @default.
- W1979290400 countsByYear W19792904002016 @default.
- W1979290400 countsByYear W19792904002017 @default.
- W1979290400 countsByYear W19792904002021 @default.
- W1979290400 countsByYear W19792904002022 @default.
- W1979290400 countsByYear W19792904002023 @default.
- W1979290400 crossrefType "journal-article" @default.
- W1979290400 hasAuthorship W1979290400A5010335715 @default.
- W1979290400 hasAuthorship W1979290400A5090003078 @default.
- W1979290400 hasConcept C121332964 @default.
- W1979290400 hasConcept C147597530 @default.
- W1979290400 hasConcept C147789679 @default.
- W1979290400 hasConcept C150394285 @default.
- W1979290400 hasConcept C152365726 @default.
- W1979290400 hasConcept C178790620 @default.
- W1979290400 hasConcept C184779094 @default.
- W1979290400 hasConcept C185592680 @default.
- W1979290400 hasConcept C2779953032 @default.
- W1979290400 hasConcept C2780378348 @default.
- W1979290400 hasConcept C2781442258 @default.
- W1979290400 hasConcept C32909587 @default.
- W1979290400 hasConcept C33790079 @default.
- W1979290400 hasConcept C504270822 @default.
- W1979290400 hasConcept C69523127 @default.
- W1979290400 hasConceptScore W1979290400C121332964 @default.
- W1979290400 hasConceptScore W1979290400C147597530 @default.
- W1979290400 hasConceptScore W1979290400C147789679 @default.
- W1979290400 hasConceptScore W1979290400C150394285 @default.
- W1979290400 hasConceptScore W1979290400C152365726 @default.
- W1979290400 hasConceptScore W1979290400C178790620 @default.
- W1979290400 hasConceptScore W1979290400C184779094 @default.
- W1979290400 hasConceptScore W1979290400C185592680 @default.
- W1979290400 hasConceptScore W1979290400C2779953032 @default.
- W1979290400 hasConceptScore W1979290400C2780378348 @default.
- W1979290400 hasConceptScore W1979290400C2781442258 @default.
- W1979290400 hasConceptScore W1979290400C32909587 @default.
- W1979290400 hasConceptScore W1979290400C33790079 @default.
- W1979290400 hasConceptScore W1979290400C504270822 @default.
- W1979290400 hasConceptScore W1979290400C69523127 @default.
- W1979290400 hasIssue "1-2" @default.
- W1979290400 hasLocation W19792904001 @default.
- W1979290400 hasOpenAccess W1979290400 @default.
- W1979290400 hasPrimaryLocation W19792904001 @default.
- W1979290400 hasRelatedWork W2004890661 @default.
- W1979290400 hasRelatedWork W2029041425 @default.
- W1979290400 hasRelatedWork W2351973615 @default.
- W1979290400 hasRelatedWork W2371493485 @default.
- W1979290400 hasRelatedWork W2385158454 @default.
- W1979290400 hasRelatedWork W2902828964 @default.
- W1979290400 hasRelatedWork W3092548534 @default.
- W1979290400 hasRelatedWork W3104552494 @default.
- W1979290400 hasRelatedWork W3160081720 @default.
- W1979290400 hasRelatedWork W4303968791 @default.
- W1979290400 hasVolume "492" @default.
- W1979290400 isParatext "false" @default.
- W1979290400 isRetracted "false" @default.
- W1979290400 magId "1979290400" @default.
- W1979290400 workType "article" @default.