FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2162227132> ?p ?o ?g. }

• W2162227132 endingPage "514" @default.
• W2162227132 startingPage "508" @default.
• W2162227132 abstract "Density functional theory calculations within the generalized-gradient approximation are used to establish the ground-state structure, equilibrium structural parameters, and electronic structure for MBeH3 phases. From the 24 structural arrangements used as inputs for structural optimization calculations, the ground-state crystal structures of MBeH3 phases have been predicted. At ambient conditions, LiBeH3 and NaBeH3 crystallize with perovskite-related orthorhombic and cubic structures, respectively. The remaining phases KBeH3, RbBeH3, and CsBeH3 crystalize in a monoclinic structure. In the predicted phases one can store up to 15.93 wt % of hydrogen. The formation energy for the MBeH3 phases have been investigated along different reaction pathways. The electronic structures reveal that all these phases are insulators with estimated band gaps varying between 1.79 and 3.44 eV." @default.
• W2162227132 created "2016-06-24" @default.
• W2162227132 creator A5031433543 @default.
• W2162227132 creator A5031928692 @default.
• W2162227132 creator A5049840275 @default.
• W2162227132 date "2007-12-19" @default.
• W2162227132 modified "2023-09-23" @default.
• W2162227132 title "Structural Phase Stability Studies on MBeH₃ (M = Li, Na, K, Rb, Cs) from Density Functional Calculations" @default.
• W2162227132 cites W1495528880 @default.
• W2162227132 cites W1618802843 @default.
• W2162227132 cites W1661156285 @default.
• W2162227132 cites W1963986625 @default.
• W2162227132 cites W1964105888 @default.
• W2162227132 cites W1964409198 @default.
• W2162227132 cites W1970127494 @default.
• W2162227132 cites W1977603338 @default.
• W2162227132 cites W1992276644 @default.
• W2162227132 cites W1996130852 @default.
• W2162227132 cites W1997540734 @default.
• W2162227132 cites W1998998666 @default.
• W2162227132 cites W2002556032 @default.
• W2162227132 cites W2003149364 @default.
• W2162227132 cites W2004189985 @default.
• W2162227132 cites W2004647787 @default.
• W2162227132 cites W2007955178 @default.
• W2162227132 cites W2015302680 @default.
• W2162227132 cites W2016583230 @default.
• W2162227132 cites W2019531322 @default.
• W2162227132 cites W2020370741 @default.
• W2162227132 cites W2022085321 @default.
• W2162227132 cites W2026975368 @default.
• W2162227132 cites W2031899575 @default.
• W2162227132 cites W2034471071 @default.
• W2162227132 cites W2038254521 @default.
• W2162227132 cites W2038583777 @default.
• W2162227132 cites W2043384515 @default.
• W2162227132 cites W2043483114 @default.
• W2162227132 cites W2047434903 @default.
• W2162227132 cites W2060439219 @default.
• W2162227132 cites W2075411355 @default.
• W2162227132 cites W2079105963 @default.
• W2162227132 cites W2079697923 @default.
• W2162227132 cites W2082303913 @default.
• W2162227132 cites W2093914988 @default.
• W2162227132 cites W2095600772 @default.
• W2162227132 cites W2102942378 @default.
• W2162227132 cites W2104270889 @default.
• W2162227132 cites W2108228294 @default.
• W2162227132 cites W2117894566 @default.
• W2162227132 cites W2123613360 @default.
• W2162227132 cites W2137710436 @default.
• W2162227132 cites W2167590372 @default.
• W2162227132 cites W2365633948 @default.
• W2162227132 doi "https://doi.org/10.1021/ic7015897" @default.
• W2162227132 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/18088114" @default.
• W2162227132 hasPublicationYear "2007" @default.
• W2162227132 type Work @default.
• W2162227132 sameAs 2162227132 @default.
• W2162227132 citedByCount "23" @default.
• W2162227132 countsByYear W21622271322015 @default.
• W2162227132 countsByYear W21622271322016 @default.
• W2162227132 countsByYear W21622271322017 @default.
• W2162227132 countsByYear W21622271322019 @default.
• W2162227132 countsByYear W21622271322021 @default.
• W2162227132 countsByYear W21622271322022 @default.
• W2162227132 countsByYear W21622271322023 @default.
• W2162227132 crossrefType "journal-article" @default.
• W2162227132 hasAuthorship W2162227132A5031433543 @default.
• W2162227132 hasAuthorship W2162227132A5031928692 @default.
• W2162227132 hasAuthorship W2162227132A5049840275 @default.
• W2162227132 hasConcept C115624301 @default.
• W2162227132 hasConcept C121332964 @default.
• W2162227132 hasConcept C125469278 @default.
• W2162227132 hasConcept C127413603 @default.
• W2162227132 hasConcept C147597530 @default.
• W2162227132 hasConcept C152365726 @default.
• W2162227132 hasConcept C155011858 @default.
• W2162227132 hasConcept C155673373 @default.
• W2162227132 hasConcept C159467904 @default.
• W2162227132 hasConcept C178790620 @default.
• W2162227132 hasConcept C184779094 @default.
• W2162227132 hasConcept C185592680 @default.
• W2162227132 hasConcept C26873012 @default.
• W2162227132 hasConcept C37243968 @default.
• W2162227132 hasConcept C44280652 @default.
• W2162227132 hasConcept C61276311 @default.
• W2162227132 hasConcept C66938386 @default.
• W2162227132 hasConcept C69523127 @default.
• W2162227132 hasConcept C8010536 @default.
• W2162227132 hasConcept C86025842 @default.
• W2162227132 hasConcept C97355855 @default.
• W2162227132 hasConceptScore W2162227132C115624301 @default.
• W2162227132 hasConceptScore W2162227132C121332964 @default.
• W2162227132 hasConceptScore W2162227132C125469278 @default.
• W2162227132 hasConceptScore W2162227132C127413603 @default.
• W2162227132 hasConceptScore W2162227132C147597530 @default.
• W2162227132 hasConceptScore W2162227132C152365726 @default.
• W2162227132 hasConceptScore W2162227132C155011858 @default.

• next