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Physical Review B - Condensed Matter and Materials Physics(2)
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scopus(4)
First-principles multiphase equation of state of carbon under extreme conditions
ArticleAbstract: We describe the construction of a multiphase equation of state for carbon at extreme pressures basedPalabras claves:Autores:Alfredo A. Correa, Benedict L.X., Bonev S.A., Schwegler E., Young D.A.Fuentes:scopusMultiphase equation of state for carbon addressing high pressures and temperatures
ArticleAbstract: We present a 5-phase equation of state for elemental carbon which addresses a wide range of densityPalabras claves:Autores:Alfredo A. Correa, Benedict L.X., Driver K.P., Hamel S., Militzer B., Qi T., Saul A., Schwegler E.Fuentes:scopusHigh-temperature ion-thermal behavior from average-atom calculations
ArticleAbstract: Atom-in-jellium calculations of the Einstein frequency were used to calculate the mean displacementPalabras claves:Autores:Alfredo A. Correa, Benedict L.X., Bennett B.I., Bethkenhagen M., Hamel S., Lockard T., Sterne P.A., Swift D.C.Fuentes:scopusMolecular Dynamics Simulations of Warm Dense Carbon
ArticleAbstract: We present classical and DFT-based molecular dynamics (MD) simulations of carbon in the warm dense mPalabras claves:Classical molecular dynamics, Density functional molecular dynamics, Equation of stateAutores:Alfredo A. Correa, Benedict L.X., Hamel S., Sanchez D.M., Whitley H.D.Fuentes:scopus