Matches in SemOpenAlex for { <https://semopenalex.org/work/W2955561301> ?p ?o ?g. }
Showing items 1 to 83 of
83
with 100 items per page.
- W2955561301 endingPage "142" @default.
- W2955561301 startingPage "135" @default.
- W2955561301 abstract "Titanium dioxide attracts great attention due to its many applications. It has been successfully employed in photocatalysis, paints, cosmetics, and medicine. It’s used in the development of a high efficiency dye sensitized solar cell. In this work, the Fritz-Haber Institut ab initio Molecular Simulation code, FHI-aims was used to investigate and obtain the most stable ground state atomic coordinates of the three major phases of TiO 2 . The exchange-correlation interactions are treated by the Linear Density Approximation. The ground state total energies were found to be; Rutile TiO 2 -55653.8689758471 eV , Anatase TiO 2 - 109308.048965066eV and Brookite TiO 2 -218614.36351209 eV ." @default.
- W2955561301 created "2019-07-12" @default.
- W2955561301 creator A5045185029 @default.
- W2955561301 creator A5055018166 @default.
- W2955561301 creator A5060301772 @default.
- W2955561301 date "2019-07-05" @default.
- W2955561301 modified "2023-09-26" @default.
- W2955561301 title "STRUCTURE OPTIMISATION OF THREE PHASES OF TITANIUM DIOXIDE" @default.
- W2955561301 hasPublicationYear "2019" @default.
- W2955561301 type Work @default.
- W2955561301 sameAs 2955561301 @default.
- W2955561301 citedByCount "0" @default.
- W2955561301 crossrefType "journal-article" @default.
- W2955561301 hasAuthorship W2955561301A5045185029 @default.
- W2955561301 hasAuthorship W2955561301A5055018166 @default.
- W2955561301 hasAuthorship W2955561301A5060301772 @default.
- W2955561301 hasConcept C121332964 @default.
- W2955561301 hasConcept C147597530 @default.
- W2955561301 hasConcept C147789679 @default.
- W2955561301 hasConcept C161790260 @default.
- W2955561301 hasConcept C171250308 @default.
- W2955561301 hasConcept C178790620 @default.
- W2955561301 hasConcept C184779094 @default.
- W2955561301 hasConcept C185592680 @default.
- W2955561301 hasConcept C191897082 @default.
- W2955561301 hasConcept C192562407 @default.
- W2955561301 hasConcept C2777402863 @default.
- W2955561301 hasConcept C2777593239 @default.
- W2955561301 hasConcept C2777889555 @default.
- W2955561301 hasConcept C2779299574 @default.
- W2955561301 hasConcept C2781442258 @default.
- W2955561301 hasConcept C506065880 @default.
- W2955561301 hasConcept C65165184 @default.
- W2955561301 hasConcept C69523127 @default.
- W2955561301 hasConceptScore W2955561301C121332964 @default.
- W2955561301 hasConceptScore W2955561301C147597530 @default.
- W2955561301 hasConceptScore W2955561301C147789679 @default.
- W2955561301 hasConceptScore W2955561301C161790260 @default.
- W2955561301 hasConceptScore W2955561301C171250308 @default.
- W2955561301 hasConceptScore W2955561301C178790620 @default.
- W2955561301 hasConceptScore W2955561301C184779094 @default.
- W2955561301 hasConceptScore W2955561301C185592680 @default.
- W2955561301 hasConceptScore W2955561301C191897082 @default.
- W2955561301 hasConceptScore W2955561301C192562407 @default.
- W2955561301 hasConceptScore W2955561301C2777402863 @default.
- W2955561301 hasConceptScore W2955561301C2777593239 @default.
- W2955561301 hasConceptScore W2955561301C2777889555 @default.
- W2955561301 hasConceptScore W2955561301C2779299574 @default.
- W2955561301 hasConceptScore W2955561301C2781442258 @default.
- W2955561301 hasConceptScore W2955561301C506065880 @default.
- W2955561301 hasConceptScore W2955561301C65165184 @default.
- W2955561301 hasConceptScore W2955561301C69523127 @default.
- W2955561301 hasIssue "2" @default.
- W2955561301 hasLocation W29555613011 @default.
- W2955561301 hasOpenAccess W2955561301 @default.
- W2955561301 hasPrimaryLocation W29555613011 @default.
- W2955561301 hasRelatedWork W1997019105 @default.
- W2955561301 hasRelatedWork W2004370853 @default.
- W2955561301 hasRelatedWork W2073899700 @default.
- W2955561301 hasRelatedWork W2135744713 @default.
- W2955561301 hasRelatedWork W2145421688 @default.
- W2955561301 hasRelatedWork W2319364557 @default.
- W2955561301 hasRelatedWork W2320027532 @default.
- W2955561301 hasRelatedWork W2389149173 @default.
- W2955561301 hasRelatedWork W2542461560 @default.
- W2955561301 hasRelatedWork W2559480485 @default.
- W2955561301 hasRelatedWork W2766754015 @default.
- W2955561301 hasRelatedWork W2766763376 @default.
- W2955561301 hasRelatedWork W2773558562 @default.
- W2955561301 hasRelatedWork W2805131911 @default.
- W2955561301 hasRelatedWork W2807378687 @default.
- W2955561301 hasRelatedWork W2916725240 @default.
- W2955561301 hasRelatedWork W2952968500 @default.
- W2955561301 hasRelatedWork W2962712007 @default.
- W2955561301 hasRelatedWork W3049714676 @default.
- W2955561301 hasRelatedWork W3198502264 @default.
- W2955561301 hasVolume "3" @default.
- W2955561301 isParatext "false" @default.
- W2955561301 isRetracted "false" @default.
- W2955561301 magId "2955561301" @default.
- W2955561301 workType "article" @default.