The influence of the matrix element on angle-resolved photoemission spectra of insulating cuprates

Microscopic model calculations of the matrix element of a dipole moment are carried out in terms of the cluster model. This matrix element determines the transition probability of electron photoemission from a one-electron orbital with symmetry γμ to a free state. The effect of the matrix element on the angular and polarization dependences in the angle-resolved photoemission spectra of insulating cuprates, such as Sr₂CuO₂Cl₂ and Ca₂CuO₂Cl₂, is analyzed under the assumption of a well-isolated ground state of the two-hole CuO ₄ ^5? cluster, namely, the Zhang-Rice singlet. The angular k dependence of the matrix element gives rise to effects, such as the residual Fermi surface, which are typical of metallic systems. An analysis of the experimental data reveals the presence of another electronic state (with different symmetry) in the vicinity of the Zhang-Rice singlet.     

Cluster method density of states for noble metals and comparison with photoemission spectra

The multiple scattering cluster method is used to calculate densities of states for Cu, Ag, and Au. The results compare favorably with experimental photoemission spectra. The method converges rapidly with the cluster size used for the calculation.     

The importance of the surface density of states in the photoemission spectra of the alkali and alkaline earth metals

Ultraviolet photoelectron spectroscopy results are shown to distinguish between the surface and bulk electronic structure of a simple metal. The spectra from Sr at low photon energies (long escape depth) is described by the bulk electronic structure; the spectra at ≈10 eV (short escape depth) is described by the surface electronic structure.     

Construct order parameters from the reduced density matrix spectra

In this paper, we try to establish a connection between a quantum information concept, i.e., the mutual information, and the conventional order parameter in condensed matter physics. We show that non-vanishing mutual information between two subsystems separated by a long distance means the existence of long-range orders in the system. By analyzing the spectra of the reduced density matrices that are used to calculate the mutual information, we show how to derive the local order operators that identify various ordered phases in condensed matter physics.     

Polarization effects in the photoemission spectra of trigonal tellurium

Strong and unequivocal polarization effects are observed on the photoemission spectra of vacuum-cleaved, $\text{(10}\text{1}\text{0)}$ Tellurium. Calculations of the energy distribution curves of the photoelectrons have been performed based on pseudopotential band structure and wave functions. The results correlate with the observations and allow for the interpretation of the measured EDC in terms of bulk properties and surface effects.     

Conditional density matrix: Entangled states in the Heisenberg representation

The application of the conditional density matrix in the Heisenberg representation to the processes caused by entanglement allows elimination of any misunderstanding of these phenomena. We consider quantum entanglement of two- and four-particle systems, quantum correlations different from entanglement, and their causes.     

Secondary illumination effects in the photoemission spectra of GaAs and CdS

The photoemission spectra of GaAs and CdS are dramatically affected by secondary illumination of the sample. Using synchrotron radiation and a computer lineshape analysis we demonstrate that valence band and core-level spectral features are all rigidly shiftedin energy by a few tenths of an electronvolt under secondary illumination. This provides conclusive evidence that photovoltaic band-bending changes are the only cause of these effects and rules out other possible mechanisms. It is therefore right to use these phenomena for quantitative studies of band bending effects and of ultralow densities of extrinsic or intrinsic surface states.     

Obtaining density of states information from self-deconvolution of Auger band-type spectra

A systematic revision of the techniques to isolate Auger peaks in experimental spectra obtained with LEED/AES analyzers has been carried out: Background subtraction, deconvolution with the elastic peak and inversion of self-convolution. New techniques have been devised and applied to the Auger spectra of graphite, aluminum, magnesium, magnesium oxide and silicon. Self-deconvolution of these spectra leads to a transition density function that has been compared with the density of states of the valence band near the surface, as given by other competitive techniques (XPS, UPS, XES) and by theory. This comparison shows that in those meterials, Auger electron spectroscopy (AES) is a sensitive probe of the electron environment of surface atoms.     

Phonon density of states of ann-component alloy

We have generalized the coherent potential approximation (CPA) of Tripathi and Behera to the case of ann-component alloy. It is seen that then-component CPA density of states reproduces the binary, ternary quartenary alloys etc when the appropriate limits are adopted.     

An X-ray photoemission investigation of the density of states of β′ -NiAl

The electronic structure of β′ -NiAl was studied by X-ray photoemission spectroscopy (XPS). The observed valence band density of states agrees quite well with the non-relativistic APW calculations of Connolly and Johnson. These results are also compared with other experimental data. The hypothesis of d-band filling is supported by our XPS measurements.     

Electron correlation effects in the valence band photoemission spectra of cooper dichloride

He I, He II and Al Kα photoemission measurements of the valence band of CuCl₂ are reported. The presence of the 3d⁸-like satellite indicates the strong correlation effects in the final state and the breakdown of the one-particle model. It is shown that the reduction of the satellite intensity in the valence band compared with the core hole emission is caused by the delocalization of the photo-hole. The satellite intensity in resonance with the super-Coster-Kronig decay is calculated.     

A study of the density of gap states in amorphous semiconductors from thermostimulated conductivity spectra

A theoretical analysis of thermostimulated conductivity spectra _TSC(T) has been applied to determine the density of gap states g(E) in a-Si: H and a-Si: H/a-SiN _x : H multilayer structures. The results for g(E) are consistent with the results deduced from Fritzsche's analytical approach as well as other methods. A comparison has been made between the two different analytical approaches for _TSC(T). We discuss the relationship between the energy of maximum thermostimulated current emission E _m and quasi-Fermi level E _q. We demonstrate that E _q could be a better parameter than E _m in the general theoretical treatment of thermostimulated conductivity.