Category archives: DIPC

The brightest end of the Lyman alpha luminosity function

The brightest end of the Lyman alpha luminosity function

AstrophysicsCosmologyDIPC Astrophysics

By DIPC

The Javalambre-Photometric Local Universe Survey, J-PLUS, is an unprecedented photometric sky survey of 8500 deg2 visible from Javalambre (Aragón, Spain), using a set of 12 broad, intermediate and narrow-band filters. The J-PLUS photometric system is well suited to study the properties of nearby galaxies (z < 0.015). However, there are a few redshift windows beyond […]

The essential physics of the Mott metal-insulator transition at negligible computational cost

The essential physics of the Mott metal-insulator transition at negligible computational cost

DIPC Electronic PropertiesQuantum physicsTheoretical physics

By DIPC

Density functional theory (DFT) is a theoretical treatment of molecules in which the electron density is considered rather than the wave functions of individual electrons. In other words, it is a way of describing many-electron, in general, many-fermion, systems in which the energy is a funtional of the density of electrons (fermions). DFT is without […]

On-surface synthesis of open-shell porphyrins

On-surface synthesis of open-shell porphyrins

ChemistryDIPC Electronic PropertiesMaterials

By DIPC

In spintronics, new memory and logic devices are being developed based on the use of spins of nuclei, atoms, or molecules, instead of electronic charges. The main advantages are an improved energy efficiency and speed of operation to store and process information. The ability of organic molecules to maintain magnetic multistability in nanoscale junctions will […]

An exotic magnetic topological heterostructure

An exotic magnetic topological heterostructure

Condensed matterDIPC Advanced materialsDIPC Electronic PropertiesMaterials

By DIPC

Topological insulators are electronic materials that have a bulk band gap like an ordinary insulator but have conducting states on their edge or surface. The conducting surface is not what makes topological insulators unique, but the fact that it is protected due to the combination of spin-orbit interactions and time-reversal symmetry. Inducing magnetism in topological […]

Magnetism in graphene nanoribbons induced by a pair of boron atoms

Magnetism in graphene nanoribbons induced by a pair of boron atoms

Condensed matterDIPC Advanced materialsDIPC Electronic PropertiesMaterials

By DIPC

Graphene nanoribbons (GNRs), are strips of graphene with ultra-thin width (<50 nm). Graphene ribbons, introduced as a theoretical model by Mitsutaka Fujita and coauthors to examine the edge and nanoscale size effect in graphene, have emerged as a promising material for nano electronics, as they combine many of the extraordinary properties of graphene with a […]

Remarkable enantiospecific response in Cross-Polarization Solid-State NMR experiments

Remarkable enantiospecific response in Cross-Polarization Solid-State NMR experiments

DIPC Computational and Theoretical Chemistry

By DIPC

If a nucleus has a non-zero spin, it behaves as a small magnet. Therefore, in an external magnetic field, the nuclear magnetic moment vector precesses about the field direction but only certain orientations are allowed by quantum rules. Thus, for hydrogen (spin 1/2) there are two possible states in the presence of a field, each […]

Desorption as a first-order phase transition

Desorption as a first-order phase transition

ChemistryCondensed matterDIPC PolymersPhysics

By DIPC

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 a single layer of molecules, atoms or ions is attached to the adsorbent surface by chemical bonds; in physisorption only van der Waals forces are involved. Adsorption […]

Magnetic Topological Quantum Chemistry, <i>ab initio</i> calculations included

Magnetic Topological Quantum Chemistry, ab initio calculations included

Condensed matterDIPC Advanced materialsMaterialsQuantum physics

By DIPC

Topological materials have special universal properties, which are protected against perturbations. Such properties are theoretically described by topology, a branch of mathematics concerned with the properties of geometrical objects that are unchanged by continuous deformations. Topological materials behave like an ordinary insulator in the bulk but have conducting states on their boundaries, i.e., edges or […]

The critical role of single atoms on the electronic properties of a metal organic network

The critical role of single atoms on the electronic properties of a metal organic network

ChemistryDIPC InterfacesMaterials

By DIPC

Organic-based materials have gained rising interest as active components in electronics, energy conversion and catalytic systems. However, the discrete nature of the molecular constituents of these systems implies a reduced electron conductance, lowering the device efficiency. In order to increase the electron delocalization through an improved structural order, which favors orbital overlap and consequently the […]