… We calculate the melting curves of both fcc-Cu and bcc-Cu and … are available from the
corresponding author upon request. … Comparison of the ab initio melting curve of Cu calculated in …

… We calculate equilibrium thermodynamic properties up to the … We apply the procedure
to the above-mentioned, … work presents a complete and very efficient methodology to …

… We here apply this method to the metals Cu simulated using … only determine a single point
(p, Tm) on the melting curve at … the melting of metals based on ab initio and effective medium …

… High temperature DFT based studies (also called ab initio … low and high temperature properties,
we calculate the solid–… From the application of MEAM parameters in predicting materials …

… We apply our accelerated scheme to the low-activation equiatomic body-centred … Neugebauer,
Efficient approach to compute melting properties fully from ab initio with application to cu, …

… elastic properties, we take the equilibrated system and apply a … (at 0 K, below melting point,
and above melting point), to … and Cu (shown in figures 3 and 4, respectively), where we find …

… difficulties connected to high melting temperature of Ta. The … therefore it was decided to apply
this particular potential in this … Calculate phase diagram of binary Cu–Ta system compared …

… All these ingredients were implemented within the Vienna ab initio … This allowed us to to
calculate the melting points of five … This trend is related to a destabilization of the cubic diamond …

… free ab initio calculations based on these two approaches has … applied to calculate the
melting properties of Al, Cu and Ni. … this issue, we apply a Voronoi analysis to calculate the void …

… ab initio predictions do as well. In the present work we therefore calculate the melting point
(and other melting properties… Similarly as found for Cu [7], we find here the same behavior for …