Publicaciones en 2022
Publications in 2022
91 – A broad perspective to particle-laden fluid interfaces systems: from chemically homogeneous particles to active colloids. Advances in Colloid and Interface Science 2022, Vol.312, p. —
90 – A Chemical-Pressure-Induced Phase Transition Controlled by Lone Electron Pair Activity. Journal of Physical Chemistry Letters 2022, Vol.13, p. 9883-9888
89 – A New Force Field for OH-for Computing Thermodynamic and Transport Properties of H2and O2in Aqueous NaOH and KOH Solutions. Journal of Physical Chemistry B 2022, Vol.126, Num. 45, p. 9376-9387
88 – A Note on the Effects of Linear Topology Preservation in Monte Carlo Simulations of Knotted Proteins. International Journal of Molecular Sciences 2022, Vol.23, Num. 22, p. 13871
87 – A simple model to engineer single-molecule conductance of acenes by chemical disubstitution. Nanoscale 2022, Vol.14, Num. 2, p. 464-472
86 – Alternating one-phase and two-phase crystallization mechanisms in octahedral patchy colloids. The Journal of chemical physics 2022, Vol.157, Num. 13, p. 134501
85 – An ab initio study of the photodissociation of the vinyl radical. Physical Chemistry Chemical Physics 2022, Vol.24, Num. 12, p. 7387-7395
84 – An introduction to classical monodromy: Applications to molecules in external fields. Journal of Mathematical Physics 2022, Vol.63, Num. 3, p. —
83 – Analytical theory for the crossover from retarded to non-retarded interactions between metal plates. Journal of physics. Condensed matter : an Institute of Physics journal 2022, Vol.34, Num. 27, p. —
82 – Boosting the Stimulated Emission Properties of Host:Guest Polymer Blends by Inserting Chain Twists in the Host Polymer. Advanced Functional Materials 2022, Vol.32, Num. 48, p. —
81 – Caracterización multianalítica de basaltos de Lanzarote como simulante regolítico y recurso de habitabilidad lunar. Geogaceta, Num. 72, 2022, , p. 51-54
80 – Charge analysis in (RE)CrO4 scheelites by combined Raman spectroscopy and computer simulations. Journal of Solid State Chemistry 2022, Vol.316, p. —
79 – Chitosan: A Promising Multifunctional Cosmetic Ingredient for Skin and Hair Care. Cosmetics 2022, Vol.9, Num. 5, p. —
78 – Circularly polarized light-induced potentials and the demise of excited states. Physical chemistry chemical physics : PCCP 2022, Vol.24, Num. 5, p. 2966-2973
77 – Combined crossed molecular beams and computational study on the N(2D) + HCCCN(X1Σ+) reaction and implications for extra-terrestrial environments. Molecular Physics 2022, Vol.120, Num. 1-2, p. —
76 – Comment on ‘Finite size effect on the existence of the liquid–vapour spinodal curve’. Molecular Physics 2022, , p. —
75 – Compressing the Channels in the Crystal Structure of Copper Squarate Metal-Organic Framework. Solids 2022, Vol.3, Num. 2, p. 374-384
74 – Conical intersection and coherent vibrational dynamics in alkyl iodides captured by attosecond transient absorption spectroscopy. Journal of Chemical Physics 2022, Vol.156, Num. 11, p. —
73 – Crossed-beam and theoretical studies of multichannel nonadiabatic reactions: branching fractions and role of intersystem crossing for O(3P) + 1,3-butadiene. Faraday Discussions 2022, Vol.238, p. 161-182
72 – Current Perspective on the Study of Liquid–Fluid Interfaces: From Fundamentals to Innovative Applications. Coatings 2022, , p. —
71 – Current Treatments for COVID-19: Application of Supercritical Fluids in the Manufacturing of Oral and Pulmonary Formulations. Pharmaceutics 2022, Vol.14, Num. 11, p. —
70 – Deep learning for unravelling features of heterogeneous ice nucleation. Proceedings of the National Academy of Sciences of the United States of America 2022, Vol.119, Num. 35, p. —
69 – Deposition of Au nanoparticles into mesoporous SiO2 SBA-15. Journal of Supercritical Fluids 2022, Vol.184, p. —
68 – Developments in ultrafast spectroscopy. Physical Chemistry Chemical Physics 2022, , p. —
67 – Dilational Rheology of Fluid/Fluid Interfaces: Foundations and Tools. Fluids 2022, Vol.7, Num. 10, p. —
66 – Dynamical anomalies and structural features of active Brownian particles characterized by two repulsive length scales. The Journal of chemical physics 2022, Vol.156, Num. 16, p. 164502
65 – Editorial: Biomimetic and bioinspired membranes to reconstruct the properties of natural systems. Frontiers in Molecular Biosciences 2022, , p. —
64 – Effects of Oil Phase on the Inversion of Pickering Emulsions Stabilized by Palmitic Acid Decorated Silica Nanoparticles. Colloids and Interfaces 2022, Vol.6, Num. 2, p. —
63 – Effects of shell-thickness on the powder morphology, magnetic behavior and stability of the chitosan-coated Fe3O4 nanoparticles. Boletín de la Sociedad Española de Cerámica y Vidrio 2022, Vol.61, Num. 4, p. 300-312
62 – Electrostatic Layer-by-Layer Self-Assembly Method: A Physico-Chemical Perspective. Supramolecular Assemblies Based on Electrostatic Interactions (Springer International Publishing), 2022, , p. 169-202
61 – Engineering the HOMO-LUMO gap of indeno[1,2-b]fluorene. Journal of Materials Chemistry C 2022, Vol.10, Num. 32, p. 11775-11782
60 – Evaluating the Impact of Hydrophobic Silicon Dioxide in the Interfacial Properties of Lung Surfactant Films. Environmental Science and Technology 2022, Vol.56, Num. 11, p. 7308-7318
59 – Evaluation of the impact of carbonaceous particles in the mechanical performance of lipid Langmuir monolayers. Colloids and Surfaces A: Physicochemical and Engineering Aspects 2022, Vol.634, p. —
58 – Fluid Films as Models for Understanding the Impact of Inhaled Particles in Lung Surfactant Layers. Coatings 2022, Vol.12, Num. 2, p. —
57 – Forces Controlling the Assembly of Particles at Fluid Interfaces. Langmuir 2022, Vol.38, Num. 44, p. 13313-13321
56 – Formation Routes of CO from O(1D)+Toluene: A Computational Study. Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics) 2022, , p. —
55 – Freezing point depression of salt aqueous solutions using the Madrid-2019 model. The Journal of chemical physics 2022, Vol.156, Num. 13, p. 134503
54 – Graphene grown on transition metal substrates: Versatile templates for organic molecules with new properties and structures. Surface Science Reports 2022, Vol.77, Num. 4, p. —
53 – Grazing incidence fast atom and molecule diffraction: theoretical challenges. Physical Chemistry Chemical Physics 2022, Vol.24, Num. 26, p. 15628-15656
52 – Homogeneity assessment of the SuperCam calibration targets onboard rover perseverance. Analytica Chimica Acta 2022, Vol.1209, p. —
51 – Homogeneous ice nucleation rates for mW and TIP4P/ICE models through Lattice Mold calculations. Journal of Chemical Physics 2022, Vol.157, Num. 9, p. —
50 – How proton transfer affects the helical parameters in DNA:DNA microhelices. Journal of Biomolecular Structure and Dynamics 2022, Vol.40, Num. 24, p. 13759-13777
49 – Hydraulically Controlled Bottom Flow in the Orkney Passage. Water (Switzerland) 2022, Vol.14, Num. 19, p. —
48 – Ice friction at the nanoscale. Proceedings of the National Academy of Sciences of the United States of America 2022, Vol.119, Num. 49, p. —
47 – Imaging the elusive C–C bond dissociation channel of photoexcited ethyl radical. Molecular Physics 2022, Vol.120, Num. 1-2, p. —
46 – Imaging the Photodissociation Dynamics and Fragment Alignment of CH2BrI at 193 nm. Journal of Physical Chemistry A 2022, Vol.126, Num. 45, p. 8404-8422
45 – Inclusion complexes of the macrocycle nonactin with benchmark protonated amines: aniline and serine. Physical Chemistry Chemical Physics 2022, Vol.24, Num. 14, p. 8422-8431
44 – Inelastic collision dynamics of oriented NO molecules with Kr atoms. Molecular Physics 2022, Vol.120, Num. 1-2, p. —
43 – Intermolecular forces at ice and water interfaces: Premelting, surface freezing, and regelation. Journal of Chemical Physics 2022, Vol.157, Num. 4, p. —
42 – Intersystem crossing in the entrance channel of the reaction of O(3P) with pyridine. Nature Chemistry 2022, Vol.14, Num. 12, p. 1405-1412
41 – Intrinsic structure perspective for MIPS interfaces in two-dimensional systems of active Brownian particles. Soft Matter 2022, Vol.18, Num. 13, p. —
40 – Iron–Gold Nanoflowers: A Promising Tool for Multimodal Imaging and Hyperthermia Therapy. Pharmaceutics 2022, Vol.14, Num. 3, p. —
39 – Layer-by-Layer Materials for the Fabrication of Devices with Electrochemical Applications. Energies 2022, Vol.15, Num. 9, p. —
38 – Lipid nanoparticles for antisense oligonucleotide gene interference into brain border-associated macrophages. Frontiers in Molecular Biosciences 2022, Vol.9, p. —
37 – LZS-1, Lanzarote (Canary Island, Spain) lunar (Apollo 14) basaltic soil simulant. Scientific Reports 2022, Vol.12, Num. 1, p. —
36 – Maximum in density of electrolyte solutions: Learning about ion-water interactions and testing the Madrid-2019 force field. Journal of Chemical Physics 2022, Vol.156, Num. 15, p. —
35 – Mechanical Characterization of Anhydrous Microporous Aluminophosphate Materials: Tridimensional Incompressibility, Ductility, Isotropy and Negative Linear Compressibility. Solids 2022, Vol.3, Num. 3, p. 457-499
34 – Melting points of water models: Current situation. Journal of Chemical Physics 2022, Vol.156, Num. 21, p. —
33 – Membrane rigidity regulates E. coli proliferation rates. Scientific Reports 2022, Vol.12, Num. 1, p. —
32 – New insights into progressive ligand replacement from [Ru2Cl(O2CCH3)4]: synthetic strategies and variation in redox potentials and paramagnetic shifts. Dalton Transactions 2022, Vol.51, Num. 25, p. 9708-9719
31 – New magnetic-fluorescent bifuntional (Y0.9Ln0.1VO4/Fe3O4)@SiO2 and [(Y0.9Ln0.1VO4@SiO2)/Fe3O4@SiO2] materials. Ceramics International 2022, Vol.48, Num. 15, p. 22047-22058
30 – On the thermodynamics of curved interfaces and the nucleation of hard spheres in a finite system. Journal of Chemical Physics 2022, Vol.156, Num. 1, p. —
29 – Outstanding reviewers for soft matter in 2021. Soft Matter 2022, , p. —
28 – Phase diagram of the NaCl-water system from computer simulations. Journal of Chemical Physics 2022, Vol.156, Num. 6, p. —
27 – Polyelectrolyte Multilayered Capsules as Biomedical Tools. Polymers 2022, Vol.14, Num. 3, p. —
26 – Reaction N(2D) + CH2CCH2(Allene): An Experimental and Theoretical Investigation and Implications for the Photochemical Models of Titan. ACS Earth and Space Chemistry 2022, Vol.6, Num. 10, p. 2305-2321
25 – Role of Low Energy Resonances in the Stereodynamics of Cold He + D2 Collisions. Journal of Physical Chemistry Letters 2022, Vol.13, Num. 18, p. 4064-4072
24 – Rotating Micro-Spheres for adsorption monitoring at a fluid interface. Journal of Colloid and Interface Science 2022, Vol.614, p. 378-388
23 – Self-energy corrected DFT-NEGF for conductance in molecular junctions: an accurate and efficient implementation for TRANSIESTA package applied to Au electrodes. Journal of Physics Condensed Matter 2022, Vol.34, Num. 43, p. —
22 – Simulating Microswimmers Under Confinement With Dissipative Particle (Hydro) Dynamics. Frontiers in Physics 2022, Vol.10, p. —
21 – Single and multi-vertices solitons in lattices of active Morse - van der Pol units. Communications in Nonlinear Science and Numerical Simulation 2022, Vol.114, p. —
20 – Soft Colloidal Particles at Fluid Interfaces. Polymers 2022, Vol.14, Num. 6, p. —
19 – Solubility of Methane in Water: Some Useful Results for Hydrate Nucleation. The journal of physical chemistry. B 2022, Vol.126, Num. 42, p. 8553-8570
18 – Spatiotemporal Control of Trapped Rydberg Qubits. Optics InfoBase Conference Papers 2022, , p. —
17 – Stereodynamics effects in grazing-incidence fast-molecule diffraction. Physical Chemistry Chemical Physics 2022, Vol.24, Num. 32, p. 19541-19551
16 – Stimulated Raman adiabatic passage with trains of weak pulses* * This work is dedicated to Bruce Shore, a brilliant and inspiring physicist, a pioneer in coherent light-matter interaction theory, a mentor and a friend.. Journal of Physics B: Atomic, Molecular and Optical Physics 2022, Vol.55, Num. 23, p. —
15 – Structural and Electronic Effect Driven Distortions in Visible Light Absorbing Polar Materials ATa2V2O11 (A = Sr, Pb). Journal of Physical Chemistry C 2022, Vol.126, Num. 18, p. 8047-8055
14 – Structural proton transfer rates in pure water according to Marcus theory and TD-DFT computations. Journal of Molecular Liquids 2022, Vol.357, p. —
13 – Studies on the molecular structure of pterocaronol: A new biologically relevant nor-triterpenoid from Peltophorum pterocarpum (Fabaceae). Journal of Molecular Structure 2022, Vol.1254, p. —
12 – Study of the Dilution-Induced Deposition of Concentrated Mixtures of Polyelectrolytes and Surfactants. Polymers 2022, Vol.14, Num. 7, p. —
11 – Superparamagnetic and light-emitting bifunctional nanocomposites of iron oxide and erbium or thulium doped yttrium orthovanadate. Journal of Alloys and Compounds 2022, Vol.929, p. —
10 – Synthesis, structural and morphological characterization and photoluminescence study of Y0.9Er0.1−xYbxVO4 materials. Journal of Alloys and Compounds 2022, Vol.903, p. —
9 – Synthetic Micro/Nanomotors for Drug Delivery. Technologies 2022, Vol.10, Num. 4, p. —
8 – The journey of tuning chitosan properties in colloidal systems: Interactions with surfactants in the bulk and on the alumina surface. Chemical Engineering Journal 2022, Vol.450, p. —
7 – The Madrid-2019 force field for electrolytes in water using TIP4P/2005 and scaled charges: Extension to the ions F-, Br-, I-, Rb+, and Cs+. Journal of Chemical Physics 2022, Vol.156, Num. 4, p. —
6 – The N(2D) + CH2CHCN (Vinyl Cyanide) Reaction: A Combined Crossed Molecular Beam and Theoretical Study and Implications for the Atmosphere of Titan. Journal of Physical Chemistry A 2022, Vol.126, Num. 36, p. 6110-6123
5 – Thermodynamics of multipolar Kihara fluids. Results from Monte Carlo simulations and molecular discrete perturbation theory. Chemical Physics Letters 2022, Vol.809, p. —
4 – Tunable gold nanorod/NAO conjugates for selective drug delivery in mitochondria-targeted cancer therapy. Nanoscale 2022, Vol.14, Num. 22, p. 8028-8040
3 – Ultrafast dynamics of push-pull nitroanilines tracked with few-femtosecond XUV-NIR spectroscopy. Optics InfoBase Conference Papers 2022, , p. —
2 – Wavelength dependence of the multiphoton ionization of CH3I by intense femtosecond laser pulses through Freeman resonances. Physical Chemistry Chemical Physics 2022, Vol.24, Num. 48, p. 29616-29628
1 – When experiment challenges theory: Scattering of vibrationally excited molecules in the cold collision energy regime. Natural Sciences 2022, Vol.2, Num. 1, p. —