S. Nagata — Page 2 | Searcharxiv

arXiv1999

Exact Treatment of the Pauli Exclusion Operator in Nuclear Matter Calculation

Exact expressions of the Pauli exclusion operator Q in the nuclear matter calculation are presented in detail. Exact formulae are also given for the calculations of the single-particle-potential energy and the binding energy per nucleon with the exact Q operator. Numerical calculations of the G matrix in the lowest-order Brueckner theory are carried out to check the reliability of the standard angle-average approximation for the Q operator by employing the Bonn B and C NN potentials. It is observed that the exact treatment of the operator Q brings about non-negligible and attractive contributions to the binding energy.

nucl-th↗

arXiv1999

Electronic Structure of Cu_(1-x)Ni_xRh_2S_4 and CuRh_2Se_4: Band Structure Calculations, X-ray Photoemission and Fluorescence Measurements

The electronic structure of spinel-type Cu_(1-x)Ni_xRh_2S_4 (x = 0.0, 0.1, 0.3, 0.5, 1.0) and CuRh_2Se_4 compounds has been studied by means of X-ray photoelectron and fluorescent spectroscopy. Cu L_3, Ni L_3, S L_(2,3) and Se M_(2,3) X-ray emission spectra (XES) were measured near thresholds at Beamline 8.0 of the Lawrence Berkeley Laboratory's Advanced Light Source. XES measurements of the constituent atoms of these compounds, reduced to the same binding energy scale, are found to be in excellent agreement with XPS valence bands. The calculated XES spectra which include dipole matrix elements show that the partial density of states reproduce experimental spectra quite well. States near the Fermi level (E_F) have strong Rh d and S(Se) p character in all compounds. In NiRh_2S_4 the Ni 3d states contribute strongly at E_F, whereas in both Cu compounds the Cu 3d bands are only ~1 eV wide and centered ~2.5 eV below E_F, leaving very little 3d character at E_F. The density of states at the Fermi level is less in NiRh_2S_4 than in CuRh_2S_4. This difference may contribute to the observed decrease, as a function of Ni concentration, in the superconducting transition temperature in Cu_(1-x)Ni_xRh_2S_4. The density of states of the ordered alloy Cu_(1/2)Ni_(1/2)Rh_2S_4 shows behavior that is more ``split-band''-like than ``rigid band''-like.

cond-mat.mtrl-sci↗