Antoni MaciÓ Escatllar
Antoni MaciÓ Escatllar
Verified email at ub.edu
Title
Cited by
Cited by
Year
Understanding the interplay between size, morphology and energy gap in photoactive TiO 2 nanoparticles
┴ Morales-GarcÝa, AM Escatllar, F Illas, ST Bromley
Nanoscale 11 (18), 9032-9041, 2019
102019
Global optimisation of hydroxylated silica clusters: A cascade Monte Carlo Basin Hopping approach
A Cuko, A Maciß, M Calatayud, ST Bromley
Computational and Theoretical Chemistry 1102, 38-43, 2017
102017
Modeling hydroxylated nanosilica: Testing the performance of ReaxFF and FFSiOH force fields
A MaciÓ Escatllar, P Ugliengo, ST Bromley
The Journal of Chemical Physics 146 (22), 224704, 2017
92017
What Can Infrared Spectra Tell Us about the Crystallinity of Nanosized Interstellar Silicate Dust Grains?
L Zamirri, A Macia Escatllar, J Mariñoso Guiu, P Ugliengo, ST Bromley
ACS Earth and Space Chemistry 3 (10), 2323-2338, 2019
42019
Structure and Properties of Nanosilicates with Olivine (Mg2SiO4)N and Pyroxene (MgSiO3)N Compositions
AM Escatllar, T Lazaukas, SM Woodley, ST Bromley
ACS Earth and Space Chemistry 3 (11), 2390-2403, 2019
42019
Efficient preparation of TiO2 nanoparticle models using interatomic potentials
A MaciÓ Escatllar, ┴ Morales-GarcÝa, F Illas, ST Bromley
The Journal of chemical physics 150 (21), 214305, 2019
42019
Properties of hydrated TiO 2 and SiO 2 nanoclusters: dependence on size, temperature and water vapour pressure
A Cuko, AM Escatllar, M Calatayud, ST Bromley
Nanoscale 10 (45), 21518-21532, 2018
42018
Computing Free Energies of Hydroxylated Silica Nanoclusters: Forcefield versus Density Functional Calculations
A MaciÓ Escatllar, P Ugliengo, ST Bromley
Inorganics 5 (3), 41, 2017
22017
Computational Modelling of TiO2 and Mg-silicate nanoclusters and nanoparticles-Crystallinity and Astrophysical Implications
A MaciÓ Escatllar
Universitat de Barcelona, 2020
2020
Assessing the viability of silicate nanoclusters as carriers of the anomalous microwave emission: a quantum mechanical study
AM Escatllar, ST Bromley
Astronomy & Astrophysics 634, A77, 2020
2020
Structure and Properties of Nanosilicates with Olivine (Mg₂Si2O₄) _ {N} and Pyroxene (MgSiO₃) _ {N} Compositions
A MaciÓ Escatllar, T Lazauskas, SM Woodley, ST Bromley
ACS Earth and Space Chemistry, 2019
2019
Stability or photoactivity? Properties of realistic TiO2 nanoparticles
┴ Morales-GarcÝa, A MaciÓ, ST Bromley, F Illasa
INTERNATIONAL WORKSHOP, 52, 0
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Articles 1–12