Publicaciones en 2023
Publications in 2023
92 – 2021 JCP Emerging Investigator Special Collection. Journal of Chemical Physics 2023
91 – A Deep Potential model for liquid-vapor equilibrium and cavitation rates of water. Journal of Chemical Physics 2023, Vol.158, Num. 18, p. —
90 – A Dynamic Proton Bond: MH+·H2O ⇌ M·H3O+ Interconversion in Loosely Coordinated Environments. Journal of Physical Chemistry Letters 2023, Vol.14, Num. 5, p. 1294-1300
89 – A High-level Ab Initio Study of the Destruction of Methanimine under UV Radiation. Astrophysical Journal 2023, Vol.956, Num. 1, p. —
88 – A Nanoparticle-Based Model System for the Study of Heterogeneous Nucleation Phenomena. Langmuir 2023, Vol.39, Num. 10, p. 3580-3588
87 – Adsorption of Mixed Dispersions of Silica Nanoparticles and an Amphiphilic Triblock Copolymer at the Water–Vapor Interface. Applied Sciences (Switzerland) 2023, Vol.13, Num. 18, p. —
86 – An ab initio study of the photodissociation of CH2I and CH2I+. Physical Chemistry Chemical Physics 2023, Vol.25, Num. 30, p. 20365-20372
85 – Anomalous Colloidal Motion under Strong Confinement. Small 2023, Vol.19, Num. 36, p. —
84 – Anomalous Concentration Dependence of Surface Tension and Concentration-Concentration Correlation Functions of Binary Non-Electrolyte Solutions. International journal of molecular sciences 2023, Vol.24, Num. 3, p. —
83 – Association of oppositely charged polyelectrolyte and surfactant in solution: equilibrium and nonequilibrium features. Journal of Physics Condensed Matter 2023, Vol.35, Num. 32, p. —
82 – Base pairs with 4-amino-3-nitrobenzonitrile: comparison with the natural WC pairs. Dimer and tetramer forms, Infrared and Raman spectra, and several proposed antiviral modified nucleosides. Journal of Biomolecular Structure and Dynamics 2023, Vol.41, Num. 10, p. 4444-4466
81 – Bioinspired chiral inorganic nanomaterials. Nature Reviews Bioengineering 2023, Vol.1, Num. 2, p. 88-106
80 – Building a Hofmeister-like series for the maximum in density temperature of aqueous electrolyte solutions. Journal of Molecular Liquids 2023, Vol.377, p. —
79 – Calcium-Alginate-Chitosan Nanoparticle as a Potential Solution for Pesticide Removal, a Computational Approach. Polymers 2023, Vol.15, Num. 14, p. 3020
78 – Chiral Seeded Growth of Gold Nanorods Into Fourfold Twisted Nanoparticles with Plasmonic Optical Activity. Advanced Materials 2023, Vol.35, Num. 1, p. —
77 – Cold Collisions of Ro-Vibrationally Excited D2 Molecules. Journal of Physical Chemistry A 2023, Vol.127, Num. 7, p. 1619-1627
76 – Colloidal Metal Nanoparticles under Ultrafast Laser Pulses. International Conference on Metamaterials, Photonic Crystals and Plasmonics 2023, , p. —
75 – Combined NMR Spectroscopy and Quantum-Chemical Calculations in Fluorescent 1,2,3-Triazole-4-carboxylic Acids Fine Structures Analysis. International Journal of Molecular Sciences 2023, Vol.24, Num. 10, p. —
74 – Computation of Electrical Conductivities of Aqueous Electrolyte Solutions: Two Surfaces, One Property. Journal of Chemical Theory and Computation 2023, Vol.19, Num. 16, p. 5380-5393
73 – Correlated proton dynamics in hydrogen bonding networks: the benchmark case of 3-hydroxyglutaric acid. Physical Chemistry Chemical Physics 2023, Vol.26, Num. 1, p. 198-208
72 – Dilution-Induced Deposition of Concentrated Binary Mixtures of Cationic Polysaccharides and Surfactants. Polymers 2023, Vol.15, Num. 14, p. —
71 – Direct Calculation of the Interfacial Free Energy between NaCl Crystal and Its Aqueous Solution at the Solubility Limit. Physical Review Letters 2023, Vol.130, Num. 11, p. —
70 – Diruthenium complexes as pH-responsive delivery systems: a quantitative assessment. Inorganic Chemistry Frontiers 2023, Vol.10, Num. 15, p. 4402-4413
69 – Easy and accurate computation of energy barriers for carbocation solvation: an expeditious tool to face carbocation chemistry. Physical Chemistry Chemical Physics 2023, Vol.25, Num. 45, p. 31012-31019
68 – Effectiveness of Gold Nanorods of Different Sizes in Photothermal Therapy to Eliminate Melanoma and Glioblastoma Cells. International Journal of Molecular Sciences 2023, Vol.24, Num. 17, p. —
67 – Effectiveness of gold nanorods of different sizes in photothermal therapy to eliminate melanoma and glioblastoma cells. CASEIB 2023. Libro de Actas del XLI Congreso Anual de la Sociedad Española de Ingeniería Biomédica: Contribuyendo a la salud basada en valor 2023, , p. —
66 – El verdadero coste de los Acuerdos Transformativos. Anales de Química de la RSEQ, Num. 4, 2023, , p. 298-302
65 – Engineering phosphatidylinositol-4,5-bisphosphate model membranes enriched in endocytic cargo: A neutron reflectometry, AFM and QCM-D structural study. Colloids and Surfaces B: Biointerfaces 2023, Vol.227, p. —
64 – Erythroid SLC7A5/SLC3A2 amino acid carrier controls red blood cell size and maturation. iScience 2023, Vol.26, Num. 1, p. —
63 – Estimation of bubble cavitation rates in a symmetrical Lennard-Jones mixture by NVT seeding simulations. Journal of Chemical Physics 2023, Vol.158, Num. 12, p. —
62 – Exploiting Hydrogen Bonding to Direct Supramolecular Polymerization at the Air/Water Interface. ChemNanoMat 2023, Vol.9, Num. 1, p. —
61 – Exploring the electronic band structure, spectroscopic signatures, and structural properties of Er3+-based hydroxyapatites co-doped with Ce3+ ions. Inorganic Chemistry Communications 2023, Vol.155, p. —
60 – Field-Pulse-Induced Annealing of 2D Colloidal Polycrystals. Nanomaterials 2023, Vol.13, Num. 3, p. —
59 – Finding, mapping, and classifying optimal protocols for two-qubit entangling gates. Physical Review A 2023, Vol.108, Num. 3, p. —
58 – Fluid Interfaces as Models for the Study of Lipid-Based Films with Biophysical Relevance. Coatings 2023, Vol.13, Num. 9, p. —
57 – Fluids meet solids. Journal of Chemical Physics 2023, , p. —
56 – From Multi- to Single-Hollow Trimetallic Nanocrystals by Ultrafast Heating. Chemistry of Materials 2023, Vol.35, Num. 22, p. 9603-9612
55 – Further extension of the Madrid-2019 force field: Parametrization of nitrate (NO3−) and ammonium (NH4+) ions. Journal of Chemical Physics 2023, Vol.159, Num. 22, p. —
54 – Growth rate of CO2 and CH4 hydrates by means of molecular dynamics simulations. The Journal of chemical physics 2023, Vol.159, Num. 6, p. —
53 – Homogeneous nucleation rate of methane hydrate formation under experimental conditions from seeding simulations. Journal of Chemical Physics 2023, Vol.158, Num. 11, p. —
52 – Hot Brownian Motion of Thermoresponsive Microgels in Optical Tweezers Shows Discontinuous Volume Phase Transition and Bistability. Small 2023, Vol.19, Num. 34, p. —
51 – How a Facet of a Nanocrystal Is Formed: The Concept of the Symmetry Based Kinematic Theory. ChemPhysChem 2023, Vol.24, Num. 2, p. —
50 – Imaging the photodissociation dynamics of internally excited ethyl radicals from high Rydberg states. Physical Chemistry Chemical Physics 2023, Vol.25, Num. 16, p. 11684-11696
49 – Inhomogeneous Canham–Helfrich Abscission in Catenoid Necks under Critical Membrane Mosaicity. Membranes 2023, Vol.13, Num. 9, p. —
48 – Interaction between acetylsalicylic acid and a cationic amphiphile model: An experimental approach using surface techniques. Chemical Physics Letters 2023, Vol.819, p. —
47 – Investigation on the relationship between lipid composition and structure in model membranes composed of extracted natural phospholipids. Journal of colloid and interface science 2023, Vol.637, p. 55-66
46 – Layer-by-Layer Nanoassemblies for Vaccination Purposes. Pharmaceutics 2023, Vol.15, Num. 5, p. —
45 – Li + HF and Li + HCl Reactions Revisited I: QCT Calculations and Simulation of Experimental Results. The journal of physical chemistry. A 2023, Vol.127, Num. 33, p. 6924-6944
44 – Light-to-Heat Conversion of Optically Trapped Hot Brownian Particles. ACS Nano 2023, Vol.17, Num. 24, p. 24961-24971
43 – Location and Concentration of Aromatic-Rich Segments Dictates the Percolating Inter-Molecular Network and Viscoelastic Properties of Ageing Condensates. Advanced Science 2023, Vol.10, Num. 25, p. —
42 – Magnetic Colloidal Currents Guided on Self-Assembled Colloidal Tracks. Advanced Functional Materials 2023, Vol.33, Num. 52, p. —
41 – Mechanical stress confers nuclear and functional changes in derived leukemia cells from persistent confined migration. Cellular and Molecular Life Sciences 2023, Vol.80, Num. 11, p. —
40 – Millifluidic Flow Reactor for Reproducible Seed-Mediated Nanoparticle Synthesis. Journal of Physical Chemistry C 2023, Vol.127, Num. 39, p. 19747-19758
39 – Minimal numerical ingredients describe chemical microswimmers’ 3-D motion. Nanoscale 2023, Vol.16, Num. 5, p. 2444-2451
38 – Minimum in the pressure dependence of the interfacial free energy between ice Ih and water. Journal of Chemical Physics 2023, Vol.158, Num. 12, p. —
37 – Modelling and Scaling-Up of a Supercritical Fluid Extraction of Emulsions Process. Processes 2023, Vol.11, Num. 4, p. —
36 – Monte Carlo simulations and molecular discrete perturbation theory of multipolar oblate Kihara fluids. Journal of Molecular Liquids 2023, Vol.383, p. —
35 – Nonmonotonous Translocation Time of Polymers across Pores. Physical Review Letters 2023, Vol.131, Num. 4, p. —
34 – On the possible locus of the liquid-liquid critical point in real water from studies of supercooled water using the TIP4P/Ice model. Journal of Chemical Physics 2023, Vol.158, Num. 20, p. —
33 – Optimal protocols for entangling gates in N-qubit atomic systems. AIP Advances 2023, Vol.13, Num. 11, p. —
32 – Optimization of iron oxide nanoparticles for MRI-guided magnetic hyperthermia tumor therapy: reassessing the role of shape in their magnetocaloric effect. Journal of Materials Chemistry B 2023, Vol.11, Num. 46, p. 11110-11120
31 – Peculiarities of the Spatial and Electronic Structure of 2-Aryl-1,2,3-Triazol-5-Carboxylic Acids and Their Salts on the Basis of Spectral Studies and DFT Calculations. International journal of molecular sciences 2023, Vol.24, Num. 18, p. —
30 – Phase equilibria for the mixtures of the deep eutectic solvent L-menthol + thymol plus CO2 at high pressure. Journal of Industrial and Engineering Chemistry 2023, Vol.121, p. 312-321
29 – Photodissociation dynamics of methylamine in the blue edge of the A -band. I. the H-atom elimination channel. Journal of Chemical Physics 2023, Vol.158, Num. 23, p. —
28 – Photodissociation dynamics of methylamine in the blue edge of the A-band. II. The NH2 + CH3 channel. The Journal of chemical physics 2023, Vol.159, Num. 6, p. —
27 – Physico-chemical challenges on the self-assembly of natural and bio-based ingredients on hair surfaces: towards sustainable haircare formulations. Green Chemistry 2023, Vol.25, Num. 20, p. 7863-7882
26 – Principles of assembly and regulation of condensates of Polycomb repressive complex 1 through phase separation. Cell Reports 2023, Vol.42, Num. 10, p. —
25 – Probing the effect of the capping polyelectrolyte on the internal structure of Layer-by-Layer decorated nanoliposomes. Journal of Colloid and Interface Science 2023, Vol.640, p. 220-229
24 – Raman spectroscopy, assisted by X-ray fluorescence and laser-induced breakdown spectroscopy, to characterise original and altered mineral phases in the NWA 2975 Martian shergottite. Journal of Raman Spectroscopy 2023, Vol.54, Num. 11, p. 1233-1247
23 – Reactions O(3P, 1D) + HCCCN(X1Σ+) (Cyanoacetylene): Crossed-Beam and Theoretical Studies and Implications for the Chemistry of Extraterrestrial Environments. Journal of Physical Chemistry A 2023, Vol.127, Num. 3, p. 685-703
22 – Rheology of Pseudomonas fluorescens biofilms: From experiments to predictive DPD mesoscopic modeling. Journal of Chemical Physics 2023, Vol.158, Num. 7, p. —
21 – Scale-up approach for the preparation of magnetic ferrite nanocubes and other shapes with benchmark performance for magnetic hyperthermia applications. Nature Protocols 2023, Vol.18, Num. 3, p. 783-809
20 – Self-diffusion and shear viscosity for the TIP4P/Ice water model. Journal of Chemical Physics 2023, Vol.158, Num. 6, p. —
19 – Stark control of multiphoton ionization through Freeman resonances in alkyl iodides. Journal of Chemical Physics 2023, Vol.159, Num. 7, p. —
18 – Stereodynamical Control of Cold Collisions between Two Aligned D2 Molecules. Physical Review Letters 2023, Vol.130, Num. 3, p. —
17 – Structural Study of a La(III) Complex of a 1,2,3-Triazole Ligand with Antioxidant Activity. Antioxidants 2023, Vol.12, Num. 10, p. —
16 – Study of the Molecular Architectures of 2-(4-Chlorophenyl)-5-(pyrrolidin-1-yl)-2H-1,2,3-triazole-4-carboxylic Acid Using Their Vibrational Spectra, Quantum Chemical Calculations and Molecular Docking with MMP-2 Receptor. Pharmaceutics 2023, Vol.15, Num. 12, p. —
15 – Supercritical Solution Impregnation of naproxen into mesoporous SiO2 SBA-15. Journal of CO2 Utilization 2023, Vol.73, p. —
14 – Surface tension of bulky colloids, capillarity under gravity, and the microscopic origin of the Kardar-Parisi-Zhang equation. Physical Review E 2023, Vol.108, Num. 2, p. —
13 – Surfactants or scaffolds? RNAs of varying lengths control the thermodynamic stability of condensates differently. Biophysical Journal 2023, Vol.122, Num. 14, p. 2973-2987
12 – Synthesis of new non-covered and silica-covered Y0.9Tm0.1-xYbxVO4 nanophosphors with emission in the visible and NIR ranges. Journal of Luminescence 2023, Vol.257, p. —
11 – The Chromatin Regulator HMGA1a Undergoes Phase Separation in the Nucleus**. ChemBioChem 2023, Vol.24, Num. 1, p. —
10 – The liquid-to-solid transition of FUS is promoted by the condensate surface. Proceedings of the National Academy of Sciences of the United States of America 2023, Vol.120, Num. 33, p. —
9 – 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), 2023, , p. 238-261
8 – The Zintl-Klemm concept and its broader extensions. Comprehensive Inorganic Chemistry III, Third Edition (Elsevier), 2023, , p. 51-73
7 – Time-Dependent Material Properties of Aging Biomolecular Condensates from Different Viscoelasticity Measurements in Molecular Dynamics Simulations. Journal of Physical Chemistry B 2023, Vol.127, Num. 20, p. 4441-4459
6 – Topical issue on dynamics and photodynamics: from isolated molecules to the condensed phase. European Physical Journal D 2023, , p. —
5 – Two-qubit atomic gates: spatio-temporal control of Rydberg interaction. Nanoscale 2023, Vol.15, Num. 9, , p. 4325-4333
4 – Ultrafast Dynamics in Donor-Acceptor Prototype Molecules by XUV-IR Attosecond Spectroscopy. European Quantum Electronics Conference, EQEC 2023 in Proceedings Conference on Lasers and Electro-Optics/Europe, CLEO/Europe 2023 and European Quantum Electronics Conference EQEC 2023, Part of Conference on Lasers and Electro-Optics/Europe, CLEO/Europe 2023 and European Quantum Electroni 2023, , p. —
3 – Ultrafast Dynamics in Donor-Acceptor Prototype Molecules by XUV-IR Attosecond Spectroscopy. 2023 Conference on Lasers and Electro-Optics Europe and European Quantum Electronics Conference, CLEO/Europe-EQEC 2023 2023, , p. —
2 – Universal behavior in complex-mediated reactions: Dynamics of S(1D) + o-D2 → D + SD at low collision energies. Journal of Chemical Physics 2023, Vol.158, Num. 18, p. —
1 – Unravelling the orientation of the inositol-biphosphate ring and its dependence on phosphatidylinositol 4,5-bisphosphate cluster formation in model membranes. Journal of Colloid and Interface Science 2023, Vol.629, 5, p. 785-795