Abstract

We present results of electronic structure calculations for UC x N1−x obtained with the relativistic Korringa-Kohn-Rostocker Greens function (RKKR-GF) method. While on the anion sites the disorder is treated within the Coherent Potential Approximation (CPA) the small change in the cation potential upon alloying is accounted for in the averaget-matrix approximation (ATA). The presence of strong local spin fluctuations forx≦0.6 restricts our treatment to the carbon rich phase, and even there we find that the observed linear specific heat coefficient is much enhanced over the bandstructure value. The computed X-ray photoemission spectra vary smoothly with composition the main change consisting in the “melting away” of the side peak at −3 eV binding energy seen in pure UC with the adjunction of nitrogen.

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