Publicacions en col·laboració amb investigadors/es de Universidad de Oviedo (32)

2024

  1. Dense Hydrated Magnesium Carbonate MgCO3·3H2O Phases

    Inorganic Chemistry, Vol. 63, Núm. 34, pp. 15762-15771

  2. Electron-deficient multicenter bonding in pnictogens and chalcogens: mechanism of formation

    Journal of Materials Chemistry C, Vol. 12, Núm. 28, pp. 10447-10474

  3. High-pressure properties of thallium orthovanadate from density-functional theory calculations

    Journal of Alloys and Compounds, Vol. 978

  4. Janus ScYCBr2 MXene as a Promising Thermoelectric Material

    ACS Applied Energy Materials, Vol. 7, Núm. 15, pp. 6598-6611

  5. Polymorphism and Phase Stability of Hydrated Magnesium Carbonate Nesquehonite MgCO3·3H2O: Negative Axial Compressibility and Thermal Expansion in a Cementitious Material

    Crystal Growth and Design, Vol. 24, Núm. 3, pp. 1159-1169

  6. Structural stability and adsorption behaviour of CO2-loaded pure silica CHA and ITW zeolites upon compression

    Microporous and Mesoporous Materials, Vol. 380

  7. Tuning the electronic properties of asymmetric YZrCOF MXene for water splitting applications: an ab initio study

    Dalton Transactions, Vol. 53, Núm. 9, pp. 4266-4277

2023

  1. Electronic and electrocatalytic properties of PbTiO3: unveiling the effect of strain and oxygen vacancy

    Dalton Transactions, Vol. 52, Núm. 34, pp. 11965-11980

  2. High-Pressure Experimental and DFT Structural Studies of Aurichalcite Mineral

    Minerals, Vol. 13, Núm. 5

  3. High-pressure structural phase transition on Bi14MoO24

    Journal of Physics and Chemistry of Solids, Vol. 182

  4. Phase stability of stress-sensitive Ag2CO3 silver carbonate at high pressures and temperatures

    Solid State Sciences, Vol. 135

  5. Structural Behavior of Minrecordite Carbonate Mineral upon Compression: Effect of Mg → Zn Chemical Substitution in Dolomite-Type Compounds

    ACS Omega, Vol. 8, Núm. 11, pp. 10403-10410

  6. The structures of inorganic crystals: A rational explanation from the chemical pressure approach and the anions in metallic matrices model

    Comprehensive Inorganic Chemistry III, Third Edition (Elsevier), pp. 238-261

2022

  1. Phase stability and dense polymorph of the BaCa(CO3)2 barytocalcite carbonate

    Scientific Reports, Vol. 12, Núm. 1

2021

  1. Compressibility and phase stability of iron-rich ankerite

    Minerals, Vol. 11, Núm. 6

  2. Crystal Structure of BaCa(CO3)2Alstonite Carbonate and Its Phase Stability upon Compression

    ACS Earth and Space Chemistry, Vol. 5, Núm. 5, pp. 1130-1139

  3. Transition path to a dense efficient-packed post-delafossite phase. Crystal structure and evolution of the chemical bonding

    Journal of Alloys and Compounds, Vol. 867

  4. Understanding the Pressure Effect on the Elastic, Electronic, Vibrational, and Bonding Properties of the CeScO3Perovskite

    Journal of Physical Chemistry C, Vol. 125, Núm. 1, pp. 107-119

2020

  1. Experimental and Theoretical Study of SbPO4 under Compression

    Inorganic Chemistry, Vol. 59, Núm. 1, pp. 287-307

  2. Generalized Stress-Redox Equivalence: A Chemical Link between Pressure and Electronegativity in Inorganic Crystals

    Inorganic Chemistry, Vol. 59, Núm. 8, pp. 5281-5291