Matches in SemOpenAlex for { <https://semopenalex.org/work/W4386050918> ?p ?o ?g. }
- W4386050918 abstract "Abstract Aluminum borides have significant practical interest as energetic additives to fuels, explosives and propellants due to their favorable thermodynamic and kinetic characteristics. Density functional theory calculations with periodic boundary conditions have been performed to evaluate the enthalpy of formation of two aluminum borides: the well‐known aluminum diboride AlB 2 and the metastable Al 1.28 B phase, which precedes the formation of AlB 2 during heat treatment of mechanically activated composite aluminum‐boron powders, as well as aluminum ion‐implanted with boron. The calculated formation enthalpy of AlB 2 is −3.6 kcal/mol, which agrees well with estimates from literature. The enthalpy of formation of Al 1.28 B, calculated for the first time, is 4.8 ± 0.4 kcal/mol. To understand the prerequisites for the formation of Al 1.28 B observed in experiments, the enthalpy of formation of supersaturated solid solutions of B in Al has been evaluated. The reasons for the preferential formation of the metastable Al 1.28 B phase over the thermodynamically stable AlB 2 phase are discussed." @default.
- W4386050918 created "2023-08-23" @default.
- W4386050918 creator A5012585876 @default.
- W4386050918 creator A5037464309 @default.
- W4386050918 creator A5046090290 @default.
- W4386050918 creator A5051688742 @default.
- W4386050918 creator A5055125332 @default.
- W4386050918 date "2023-08-21" @default.
- W4386050918 modified "2023-10-17" @default.
- W4386050918 title "Metastable aluminum boride: <scp>density functional theory</scp> study of prerequisites of formation" @default.
- W4386050918 cites W1970127494 @default.
- W4386050918 cites W1981368803 @default.
- W4386050918 cites W1991264631 @default.
- W4386050918 cites W2006412388 @default.
- W4386050918 cites W2009939222 @default.
- W4386050918 cites W2013497367 @default.
- W4386050918 cites W2022308914 @default.
- W4386050918 cites W2022576129 @default.
- W4386050918 cites W2022838757 @default.
- W4386050918 cites W2028135595 @default.
- W4386050918 cites W2036113194 @default.
- W4386050918 cites W2051432126 @default.
- W4386050918 cites W2064205859 @default.
- W4386050918 cites W2070059498 @default.
- W4386050918 cites W2083059286 @default.
- W4386050918 cites W2093360760 @default.
- W4386050918 cites W2102940758 @default.
- W4386050918 cites W2120145199 @default.
- W4386050918 cites W2325592601 @default.
- W4386050918 cites W2330426360 @default.
- W4386050918 cites W2774266027 @default.
- W4386050918 cites W2947428242 @default.
- W4386050918 cites W2952005776 @default.
- W4386050918 cites W2965866062 @default.
- W4386050918 cites W2981398608 @default.
- W4386050918 cites W3000631030 @default.
- W4386050918 cites W3044908225 @default.
- W4386050918 cites W3090976449 @default.
- W4386050918 cites W3114687310 @default.
- W4386050918 cites W3184731116 @default.
- W4386050918 doi "https://doi.org/10.1002/qua.27219" @default.
- W4386050918 hasPublicationYear "2023" @default.
- W4386050918 type Work @default.
- W4386050918 citedByCount "0" @default.
- W4386050918 crossrefType "journal-article" @default.
- W4386050918 hasAuthorship W4386050918A5012585876 @default.
- W4386050918 hasAuthorship W4386050918A5037464309 @default.
- W4386050918 hasAuthorship W4386050918A5046090290 @default.
- W4386050918 hasAuthorship W4386050918A5051688742 @default.
- W4386050918 hasAuthorship W4386050918A5055125332 @default.
- W4386050918 hasConcept C121332964 @default.
- W4386050918 hasConcept C147368240 @default.
- W4386050918 hasConcept C147597530 @default.
- W4386050918 hasConcept C147789679 @default.
- W4386050918 hasConcept C152365726 @default.
- W4386050918 hasConcept C178790620 @default.
- W4386050918 hasConcept C185592680 @default.
- W4386050918 hasConcept C190764699 @default.
- W4386050918 hasConcept C191897082 @default.
- W4386050918 hasConcept C192562407 @default.
- W4386050918 hasConcept C2776723582 @default.
- W4386050918 hasConcept C3288061 @default.
- W4386050918 hasConcept C44280652 @default.
- W4386050918 hasConcept C501308230 @default.
- W4386050918 hasConcept C513153333 @default.
- W4386050918 hasConcept C59801894 @default.
- W4386050918 hasConcept C89464430 @default.
- W4386050918 hasConcept C97355855 @default.
- W4386050918 hasConceptScore W4386050918C121332964 @default.
- W4386050918 hasConceptScore W4386050918C147368240 @default.
- W4386050918 hasConceptScore W4386050918C147597530 @default.
- W4386050918 hasConceptScore W4386050918C147789679 @default.
- W4386050918 hasConceptScore W4386050918C152365726 @default.
- W4386050918 hasConceptScore W4386050918C178790620 @default.
- W4386050918 hasConceptScore W4386050918C185592680 @default.
- W4386050918 hasConceptScore W4386050918C190764699 @default.
- W4386050918 hasConceptScore W4386050918C191897082 @default.
- W4386050918 hasConceptScore W4386050918C192562407 @default.
- W4386050918 hasConceptScore W4386050918C2776723582 @default.
- W4386050918 hasConceptScore W4386050918C3288061 @default.
- W4386050918 hasConceptScore W4386050918C44280652 @default.
- W4386050918 hasConceptScore W4386050918C501308230 @default.
- W4386050918 hasConceptScore W4386050918C513153333 @default.
- W4386050918 hasConceptScore W4386050918C59801894 @default.
- W4386050918 hasConceptScore W4386050918C89464430 @default.
- W4386050918 hasConceptScore W4386050918C97355855 @default.
- W4386050918 hasIssue "22" @default.
- W4386050918 hasLocation W43860509181 @default.
- W4386050918 hasOpenAccess W4386050918 @default.
- W4386050918 hasPrimaryLocation W43860509181 @default.
- W4386050918 hasRelatedWork W1997495823 @default.
- W4386050918 hasRelatedWork W2002123685 @default.
- W4386050918 hasRelatedWork W2007314952 @default.
- W4386050918 hasRelatedWork W2040139291 @default.
- W4386050918 hasRelatedWork W2047031955 @default.
- W4386050918 hasRelatedWork W2088593227 @default.
- W4386050918 hasRelatedWork W2265192070 @default.
- W4386050918 hasRelatedWork W2793256332 @default.
- W4386050918 hasRelatedWork W2950691364 @default.
- W4386050918 hasRelatedWork W3037053339 @default.