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Structures of exohedrally decorated C60-Fullerenes

In our most recent publication we studied the exohedrally metal decorated carbon-fullerenes. These systems are a promising material for its good hydrogen adsorption (high concentrations and with optimal binding energies) properties. Since their geometry and type of coverage play a key role in determining the H2 adsorption mechanism, in this paper just accepted in Carbon …

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Searching hole-electron substitutional dopants for TCO technologies

The combination of optical transparency and high electrical conductivity enables transparent conductive oxide (TCO) materials to be used for a wide range of applications -from simple smart window coatings to OLEDs and futuristic see-through displays.  Doped tin-dioxide (SnO2) is an important semiconductor that is already used for these applications. However, in order to uncover the …

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Gravitational waves

Electromagnetic radiation is not longer the only way to probe the universe: Gravitational waves are in!  Gravitational waves are ‘ripples’ in the fabric of space-time caused by some of the most violent and energetic processes in the Universe. Albert Einstein predicted the existence of gravitational waves in 1916 in his general theory of relativity. Einstein’s …

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Resolving the open controversies on the anomalous #superconducting trends in metastable phases of #Phosphorus

Among elemental compounds, the high-pressure superconducting phase diagram of phosphorus is one of the most complex. In this work, we measured electrical resistivity and performed ab initio superconductivity calculations in order to solve, for the first time the open controversies on the anomalous superconducting trends. Our work forms on a single picture a consistent scenario …

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