Matches in SemOpenAlex for { <https://semopenalex.org/work/W2602333028> ?p ?o ?g. }
Showing items 1 to 74 of
74
with 100 items per page.
- W2602333028 abstract "We report calculations using density functional theory (DFT) for the conductance of an organic molecule that has been studied experimentally by Reichert et al. (Phys. Rev. Lett. 88 (2002) 176804). Our calculations are based on the nonequilibrium Green's function formalism and on density functional calculations using TURBOMOLE. We find qualitative agreement with experimental findings. In order to address possible reasons for quantitative discrepancies a detailed study of the conductance change upon modification of the microscopic conditions (e.g. the sulfur–gold bonding) is presented." @default.
- W2602333028 created "2017-04-07" @default.
- W2602333028 creator A5020738851 @default.
- W2602333028 creator A5031305744 @default.
- W2602333028 creator A5059568366 @default.
- W2602333028 date "2003-01-01" @default.
- W2602333028 modified "2023-09-25" @default.
- W2602333028 title "Coherent transport through a molecular wire: DFT calculation" @default.
- W2602333028 hasPublicationYear "2003" @default.
- W2602333028 type Work @default.
- W2602333028 sameAs 2602333028 @default.
- W2602333028 citedByCount "0" @default.
- W2602333028 crossrefType "journal-article" @default.
- W2602333028 hasAuthorship W2602333028A5020738851 @default.
- W2602333028 hasAuthorship W2602333028A5031305744 @default.
- W2602333028 hasAuthorship W2602333028A5059568366 @default.
- W2602333028 hasConcept C121332964 @default.
- W2602333028 hasConcept C121864883 @default.
- W2602333028 hasConcept C121932024 @default.
- W2602333028 hasConcept C142362112 @default.
- W2602333028 hasConcept C152365726 @default.
- W2602333028 hasConcept C153349607 @default.
- W2602333028 hasConcept C192562407 @default.
- W2602333028 hasConcept C26873012 @default.
- W2602333028 hasConcept C32909587 @default.
- W2602333028 hasConcept C41999313 @default.
- W2602333028 hasConcept C558565934 @default.
- W2602333028 hasConcept C62520636 @default.
- W2602333028 hasConcept C73301696 @default.
- W2602333028 hasConcept C74859849 @default.
- W2602333028 hasConcept C97355855 @default.
- W2602333028 hasConceptScore W2602333028C121332964 @default.
- W2602333028 hasConceptScore W2602333028C121864883 @default.
- W2602333028 hasConceptScore W2602333028C121932024 @default.
- W2602333028 hasConceptScore W2602333028C142362112 @default.
- W2602333028 hasConceptScore W2602333028C152365726 @default.
- W2602333028 hasConceptScore W2602333028C153349607 @default.
- W2602333028 hasConceptScore W2602333028C192562407 @default.
- W2602333028 hasConceptScore W2602333028C26873012 @default.
- W2602333028 hasConceptScore W2602333028C32909587 @default.
- W2602333028 hasConceptScore W2602333028C41999313 @default.
- W2602333028 hasConceptScore W2602333028C558565934 @default.
- W2602333028 hasConceptScore W2602333028C62520636 @default.
- W2602333028 hasConceptScore W2602333028C73301696 @default.
- W2602333028 hasConceptScore W2602333028C74859849 @default.
- W2602333028 hasConceptScore W2602333028C97355855 @default.
- W2602333028 hasLocation W26023330281 @default.
- W2602333028 hasOpenAccess W2602333028 @default.
- W2602333028 hasPrimaryLocation W26023330281 @default.
- W2602333028 hasRelatedWork W1968097123 @default.
- W2602333028 hasRelatedWork W1981224482 @default.
- W2602333028 hasRelatedWork W2022021754 @default.
- W2602333028 hasRelatedWork W2029682110 @default.
- W2602333028 hasRelatedWork W2051013520 @default.
- W2602333028 hasRelatedWork W2051054968 @default.
- W2602333028 hasRelatedWork W2054691255 @default.
- W2602333028 hasRelatedWork W2060576616 @default.
- W2602333028 hasRelatedWork W2074723200 @default.
- W2602333028 hasRelatedWork W2089306664 @default.
- W2602333028 hasRelatedWork W2089908203 @default.
- W2602333028 hasRelatedWork W2098113948 @default.
- W2602333028 hasRelatedWork W2104688602 @default.
- W2602333028 hasRelatedWork W2161193695 @default.
- W2602333028 hasRelatedWork W2161692217 @default.
- W2602333028 hasRelatedWork W2770350754 @default.
- W2602333028 hasRelatedWork W2889784549 @default.
- W2602333028 hasRelatedWork W2915287687 @default.
- W2602333028 hasRelatedWork W2949372810 @default.
- W2602333028 hasRelatedWork W3144252146 @default.
- W2602333028 hasVolume "18" @default.
- W2602333028 isParatext "false" @default.
- W2602333028 isRetracted "false" @default.
- W2602333028 magId "2602333028" @default.
- W2602333028 workType "article" @default.