Matches in SemOpenAlex for { <https://semopenalex.org/work/W2093498566> ?p ?o ?g. }
- W2093498566 abstract "We present a method of determining an interfacial phase diagram using density functional theory calculations for interface energetics. Cluster expansions based on these calculations are used in Monte Carlo simulations to obtain configurational free energies. The method is applied to study the segregation of V to the $mathit{WC}(0001)/mathrm{Co}$ interface and to construct the corresponding interface diagram, a ``complexion'' phase diagram. By CALPHAD-type analysis for the adjoining bulk phases, a connection with real materials is made. We find that, in equilibrium, the interface contains a thin V-rich film for a wide range of temperatures and chemical potentials of V corresponding to V additions below the ${(mathrm{V},mathrm{W})mathrm{C}}_{x}$ solubility limit. The results are compared with available experimental data, and implications of the strong segregation of V for the sintering process of V-doped WC-Co are discussed." @default.
- W2093498566 created "2016-06-24" @default.
- W2093498566 creator A5032088286 @default.
- W2093498566 creator A5061735362 @default.
- W2093498566 date "2012-07-05" @default.
- W2093498566 modified "2023-10-12" @default.
- W2093498566 title "First-principles study of an interfacial phase diagram in the V-doped WC-Co system" @default.
- W2093498566 cites W1968175261 @default.
- W2093498566 cites W1969432234 @default.
- W2093498566 cites W1969637398 @default.
- W2093498566 cites W1970127494 @default.
- W2093498566 cites W1970493850 @default.
- W2093498566 cites W1973509433 @default.
- W2093498566 cites W1978851437 @default.
- W2093498566 cites W1979544533 @default.
- W2093498566 cites W1981368803 @default.
- W2093498566 cites W1981761090 @default.
- W2093498566 cites W1981986086 @default.
- W2093498566 cites W1983604537 @default.
- W2093498566 cites W1984193832 @default.
- W2093498566 cites W1984440746 @default.
- W2093498566 cites W1986502818 @default.
- W2093498566 cites W1986575501 @default.
- W2093498566 cites W1988282247 @default.
- W2093498566 cites W1997437474 @default.
- W2093498566 cites W1999549092 @default.
- W2093498566 cites W2001325416 @default.
- W2093498566 cites W2001627606 @default.
- W2093498566 cites W2004256385 @default.
- W2093498566 cites W2008518218 @default.
- W2093498566 cites W2008721588 @default.
- W2093498566 cites W2016934895 @default.
- W2093498566 cites W2018990000 @default.
- W2093498566 cites W2019966806 @default.
- W2093498566 cites W2021787975 @default.
- W2093498566 cites W2022047494 @default.
- W2093498566 cites W2022298832 @default.
- W2093498566 cites W2034210026 @default.
- W2093498566 cites W2037297098 @default.
- W2093498566 cites W2040768425 @default.
- W2093498566 cites W2043332726 @default.
- W2093498566 cites W2046505730 @default.
- W2093498566 cites W2047036170 @default.
- W2093498566 cites W2051613406 @default.
- W2093498566 cites W2051930530 @default.
- W2093498566 cites W2056373174 @default.
- W2093498566 cites W2063669645 @default.
- W2093498566 cites W2064807075 @default.
- W2093498566 cites W2070043464 @default.
- W2093498566 cites W2073476422 @default.
- W2093498566 cites W2077282188 @default.
- W2093498566 cites W2081055846 @default.
- W2093498566 cites W2083222334 @default.
- W2093498566 cites W2086333140 @default.
- W2093498566 cites W2089235183 @default.
- W2093498566 cites W2089306245 @default.
- W2093498566 cites W2090584394 @default.
- W2093498566 cites W2093836814 @default.
- W2093498566 cites W2094292686 @default.
- W2093498566 cites W2099077825 @default.
- W2093498566 cites W2107023214 @default.
- W2093498566 cites W2111349554 @default.
- W2093498566 cites W2118537158 @default.
- W2093498566 cites W2139130269 @default.
- W2093498566 cites W2160670798 @default.
- W2093498566 cites W2170078525 @default.
- W2093498566 cites W2171548936 @default.
- W2093498566 cites W2171930583 @default.
- W2093498566 cites W3102933769 @default.
- W2093498566 cites W3104360725 @default.
- W2093498566 cites W4230805644 @default.
- W2093498566 cites W4239610818 @default.
- W2093498566 doi "https://doi.org/10.1103/physrevb.86.035403" @default.
- W2093498566 hasPublicationYear "2012" @default.
- W2093498566 type Work @default.
- W2093498566 sameAs 2093498566 @default.
- W2093498566 citedByCount "32" @default.
- W2093498566 countsByYear W20934985662012 @default.
- W2093498566 countsByYear W20934985662013 @default.
- W2093498566 countsByYear W20934985662014 @default.
- W2093498566 countsByYear W20934985662015 @default.
- W2093498566 countsByYear W20934985662016 @default.
- W2093498566 countsByYear W20934985662017 @default.
- W2093498566 countsByYear W20934985662018 @default.
- W2093498566 countsByYear W20934985662019 @default.
- W2093498566 countsByYear W20934985662020 @default.
- W2093498566 countsByYear W20934985662021 @default.
- W2093498566 countsByYear W20934985662022 @default.
- W2093498566 countsByYear W20934985662023 @default.
- W2093498566 crossrefType "journal-article" @default.
- W2093498566 hasAuthorship W2093498566A5032088286 @default.
- W2093498566 hasAuthorship W2093498566A5061735362 @default.
- W2093498566 hasBestOaLocation W20934985662 @default.
- W2093498566 hasConcept C105795698 @default.
- W2093498566 hasConcept C121332964 @default.
- W2093498566 hasConcept C147789679 @default.
- W2093498566 hasConcept C155574463 @default.
- W2093498566 hasConcept C164866538 @default.
- W2093498566 hasConcept C185592680 @default.
- W2093498566 hasConcept C186399060 @default.