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Antonio Mira de Amescua (Guadix, Granada, c. 1574-1644). España. De familia noble, estudió teología en Guadix y Granada, mezclando su sacerdocio con su dedicación a la literatura. Estuvo en Nápoles al servicio del c...

Antonio Mira de Amescua (Guadix, Granada, c. 1574-1644). España. De familia noble, estudió teología en Guadix y Granada, mezclando su sacerdocio con su dedicación a la literatura. Estuvo en Nápoles al servicio del c...

Antonio Mira de Amescua (Guadix, Granada, c. 1574-1644). España. De familia noble, estudió teología en Guadix y Granada, mezclando su sacerdocio con su dedicación a la literatura. Estuvo en Nápoles al servicio del c...

Materias / palabras clave: Public administration; Administrative law; Administración pública; Derecho administrativo

Materias / palabras clave: condensed matter physics, superconductivity; Science: Physics

We present ab initio quantum-mechanical molecular-dynamics simulations of the liquid-metal--amorphous-semiconductor transition in Ge. Our simulations are based on (a) finite-temperature density-functional theory of the o...

We propose a simple analytic representation of the correlation energy ${\mathrm{\ensuremath{\varepsilon}}}_{\mathit{c}}$ for a uniform electron gas, as a function of density parameter ${\mathit{r}}_{\mathit{s}}$ and rela...

We present a simple procedure to generate first-principles norm-conserving pseudopotentials, which are designed to be smooth and therefore save computational resources when used with a plane-wave basis. We found that the...

We demonstrate how by taking better account of electron correlations in the $3d$ shell of metal ions in nickel oxide it is possible to improve the description of both electron energy loss spectra and parameters character...

The formal relationship between ultrasoft (US) Vanderbilt-type pseudopotentials and Bl\"ochl's projector augmented wave (PAW) method is derived. It is shown that the total energy functional for US pseudopotentials can be...

Examination of nature's favorite molecules reveals a striking preference for making carbon-heteroatom bonds over carbon-carbon bonds-surely no surprise given that carbon dioxide is nature's starting material and that mos...

First-principles simulation, meaning density-functional theory calculations with plane waves and pseudopotentials, has become a prized technique in condensed-matter theory. Here I look at the basics of the suject, give a...