Author archives: DIPC

Topology of disconnected elementary band representations

Topology of disconnected elementary band representations

Condensed matterMaterialsPhysicsQuantum physicsTheoretical physics

By DIPC

The revolutionary theory of topological quantum chemistry , a description of the universal global properties of all possible band structures and materials, diagnoses topological phases based on elementary band representations. A set of bands is topological if it lacks an “atomic limit” that obeys the crystal symmetry (and time reversal, if desired): formally, an atomic […]

Surface-Enhanced Molecular Electron Energy Loss Spectroscopy

Surface-Enhanced Molecular Electron Energy Loss Spectroscopy

Condensed matterMaterialsNanotechnologyPhysicsQuantum physicsTheoretical physics

By DIPC

Chemists have a range of different spectroscopic techniques to study organic molecules. All of these techniques are based on spectra generated by a range of electronic transitions and vibrations, key excitations in matter, the study of which provides information about characteristics of materials and, therefore, allow their identification. In this context, one of those spectroscopic […]

HOTI bismuth

HOTI bismuth

Condensed matterMaterialsNanotechnologyPhysicsQuantum physicsTheoretical physics

By DIPC

The properties of bismuth have long defied classification, placing it in a category of its own. Now, as if it was not enough, it turns out its electronic structure has higher-order topology. This has been shown by an international team with the participation of Maia G. Vergniory (DIPC, Ikerbasque, UPV/EHU) and coordinated by Titus Neupert […]

The microscopic mechanism behind the vibrational relaxation of adsorbates on metal surfaces

The microscopic mechanism behind the vibrational relaxation of adsorbates on metal surfaces

Condensed matterMaterialsNanotechnologyPhysicsTheoretical physics

By DIPC

Most of the theories describing dynamical processes at surfaces rely on the validity of the adiabatic Born-Oppenheimer approximation. What does this mean? We have already seen that adsorption commonly is understood as the reversible binding of molecules and atoms from the gaseous or liquid phase on surfaces, mostly of highly porous adsorbent media. In chemisorption […]

The mechanochemistry of E. coli type 1 pilus

The mechanochemistry of E. coli type 1 pilus

BiochemistryBiomedicineMicrobiology

By DIPC

Uropathogenic Escherichia coli (UPEC) is responsible for approximately 90% of urinary tract infections (UTI) seen in individuals with an ordinary anatomy. In ascending infections, fecal bacteria colonize the urethra and spread up the urinary tract to the bladder as well as to the kidneys (causing pyelonephritis), o or the prostate in males. Because women have […]

Helium atom scattering can measure electron−phonon interaction properties of surfaces

Helium atom scattering can measure electron−phonon interaction properties of surfaces

Condensed matterMaterialsQuantum physics

By DIPC

Atom scattering at low energies has a long history as a useful probe of surface properties. The most common atomic projectiles are helium atoms formed into a monoenergetic beam directed toward the surface with energies in the thermal range, meaning kinetic energies less than 100 meV. From ordered surfaces the scattered spectra consist of sharp […]

Solvent-induced reversible clustering of gold nanoparticles

Solvent-induced reversible clustering of gold nanoparticles

ChemistryCondensed matterMaterialsNanotechnology

By DIPC

Many methods can be used to synthesise non-molecular inorganic solids. Some solids can be prepared by a variety of routes but others, especially those that are not thermodynamically stable, may be much more difficult to prepare and may require special methods. Non-molecular inorganic solids can also be prepared in various forms, as fibres, films, foams […]

Beyond the point-dipole approximation

Beyond the point-dipole approximation

Condensed matterMaterialsQuantum physicsTheoretical physics

By DIPC

The wave nature of light expresses itself in the propagation all over space, showing an intrinsic limitation to be localized beyond the so-called diffraction limit which is of the order of half the wavelength of the photons propagating. However when interacting with matter, light often gets reflected, diffracted, scattered or absorbed depending on the interactions […]

The flexibility of 2D silica

The flexibility of 2D silica

Condensed matterMaterialsNanotechnologyPhysics

By DIPC

Since the discovery that graphene, the two dimensional carbon allotrope, can be isolated and incorporated into electronic devices intense research efforts have been triggered. Driving forces usually mentioned behind the experimental and theoretical studies of graphene are the exceptional electronic properties, in particular the high electron mobilities, the long spin coherence lengths and the possibility […]

How to extract the interacting spectral function from a ground state DFT calculation

How to extract the interacting spectral function from a ground state DFT calculation

Condensed matterNanotechnologyPhysicsQuantum physicsTheoretical physics

By DIPC

The electronic wave function of an n-electron molecule depends on 3n spatial and n spin coordinates. In a sense, the wave function of a many-electron molecule contains more information than is needed and is lacking in direct physical significance. This has prompted the search for methods that involve fewer variables than the wave function and […]