Estructura electrónica y simulación de sólidos y materiales
EENSNSLM
Malta Consolider
Madrid, EspañaPublicaciones en colaboración con investigadores/as de Malta Consolider (42)
2023
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High-Pressure Vibrational and Structural Properties of Ni3V2O8 and Co3V2O8 up to 20 GPa
Journal of Physical Chemistry C, Vol. 127, Núm. 44, pp. 21684-21694
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High-pressure evolution of silver iodate (AgIO3) and the γ- AgIO3 phase
Physical Review Materials, Vol. 7, Núm. 8
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Joint experimental and theoretical study of PbGa2S4 under compression
Journal of Materials Chemistry C, Vol. 11, Núm. 34, pp. 11606-11619
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Pressure-induced phase transition and band-gap decrease in semiconducting Na3Bi(IO3)6
Results in Physics, Vol. 44
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Solid-State Synthesis and Phase Transitions in the RE2(MoO4)3 Family Monitored by Thermodiffraction
Crystal Growth and Design, Vol. 23, Núm. 4, pp. 2417-2429
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Structural and Luminescence Properties of Cu(I)X-Quinoxaline under High Pressure (X = Br, I)
Crystals, Vol. 13, Núm. 1
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Structural, vibrational, and electronic behavior of two GaGeTe polytypes under compression
Materials Today Advances, Vol. 19
2022
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High-Pressure Synthesis of β- And α-In2Se3-Like Structures in Ga2S3
Chemistry of Materials, Vol. 34, Núm. 13, pp. 6068-6086
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Physical Properties and Structural Stability of Cobalt Pyrovanadate Co2V2O7under High-Pressure Conditions
Journal of Physical Chemistry C, Vol. 126, Núm. 31, pp. 13416-13426
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Pressure-Induced Phase Transition and Band Gap Decrease in Semiconducting β-Cu2V2O7
Inorganic Chemistry, Vol. 61, Núm. 8, pp. 3697-3707
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The structure of sc16 GaP obtained at 17.5 GPa and 1400 K
High Pressure Research, Vol. 42, Núm. 3, pp. 294-302
2021
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Pressure-induced order-disorder transitions in β-In2S3: An experimental and theoretical study of structural and vibrational properties
Physical Chemistry Chemical Physics, Vol. 23, Núm. 41, pp. 23625-23642
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Structural, vibrational and electronic properties of α′-Ga2S3under compression
Physical Chemistry Chemical Physics, Vol. 23, Núm. 11, pp. 6841-6862
2020
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Orpiment under compression: Metavalent bonding at high pressure
Physical Chemistry Chemical Physics, Vol. 22, Núm. 6, pp. 3352-3369
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Phase Behavior of TmVO4 under Hydrostatic Compression: An Experimental and Theoretical Study
Inorganic Chemistry, Vol. 59, Núm. 7, pp. 4882-4894
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Structural and Lattice-Dynamical Properties of Tb2O3 under Compression: A Comparative Study with Rare Earth and Related Sesquioxides
Inorganic chemistry, Vol. 59, Núm. 14, pp. 9648-9666
2019
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Equation of state and structural characterization of Cu 4 I 4 {PPh 2 (CH 2 CH = CH 2 )} 4 under pressure
High Pressure Research, Vol. 39, Núm. 1, pp. 69-80
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A high-pressure investigation of the synthetic analogue of chalcomenite, CuSeO3·2H2O
Crystals, Vol. 9, Núm. 12
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High-Pressure Single-Crystal X-ray Diffraction of Lead Chromate: Structural Determination and Reinterpretation of Electronic and Vibrational Properties
Inorganic Chemistry, Vol. 58, Núm. 9, pp. 5966-5979
2018
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Metastable States in Pressurized Bulk and Mesoporous Germanium
Journal of Physical Chemistry C, Vol. 122, Núm. 20, pp. 10929-10938