Inicio > AGUADO RODRIGUEZ, ANDRES

AGUADO RODRIGUEZ, ANDRES

PROFESORES TITULARES DE UNIVERSIDAD
Física Teórica, Atómica y Óptica
Propiedades Nanométricas de la Materia
 
aguado@uva.es

Índice H en Scopus: 33
 

[][com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=65981]], camposKey:1463-9076 2021-11-21 Why are Zn-rich Zn-Mg nanoalloys optimal protective coatings against corrosion? A first-principles study of the initial stages of the oxidation process2468524698, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=66113]], camposKey:1359-6454 2021-01-01 A neural network potential for searching the atomic structures of pure and mixed nanoparticles. Application to ZnMg nanoalloys with an eye on their anticorrosive properties00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=59800]], camposKey:2040-3364 2020-10-21 Incorporating charge transfer effects into a metallic empirical potential for accurate structure determination in (ZnMg)(N)nanoalloys2043220448, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=47652]], camposKey:1463-9076 2019-01-01 Computational characterisation of structure and metallicity in small neutral and singly-charged cadmium clusters1232112334, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=47653]], camposKey:2040-3364 2018-01-01 Are zinc clusters really amorphous? A detailed protocol for locating global minimum structures of clusters1916219181, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37444]], camposKey:0010-938X 2017-01-01 Nanoscale reactivity of ZnxMg20x investigated by structural and electronic indicators3545, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38412]], camposKey:1476-1122 2016-01-01 Nanoparticles: Neither solid nor liquid931933, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37453]], camposKey:1932-7447 2015-12-10 Zn17 Superatom Cage Doped with 3d Transition-Metal (TM) Impurities (TM = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, and Cu)2783827847, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37454]], camposKey:1932-7447 2015-05-21 Structural, vibrational, and magnetic properties of FeCoO<inf>n</inf><sup>0/+</sup> (n = 1-6) bimetallic oxide clusters1120011209, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37456]], camposKey:1433-7851 2015-02-09 Insulating or metallic: Coexistence of different electronic phases in zinc clusters21112115, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37457]], camposKey:1463-9076 2015-01-01 A new magnetic superatom: Cr@Zn172803328043, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38435]], camposKey:2210-271X 2013-10-01 Structures, relative stabilities, and electronic properties of potassium clusters K-n (13 <= n <= 80)135143, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38444]], camposKey:1948-7185 2013-07-18 Electronic Shell and Dynamical Coexistence Effects in the Melting of Aluminum Clusters: An Interpretation of the Calorimetric Experiments Through Computer Simulation23972403, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1009]], camposKey:0301-0104 2012-05-03 On the electric dipole moments of small sodium clusters from different theoretical approaches252257, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38423]], camposKey:1932-7447 2012-03-29 Discovery of Magnetic Superatoms and Assessment of van der Waals Dispersion Effects in Cs-n Clusters68416851, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38450]], camposKey:2040-3364 2012-01-01 Neutral and charged gallium clusters: structures, physical properties and implications for the melting features64816492, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=37482]], camposKey:1098-0121 2011-10-25 Structural and zero-point vibrational effects on the electric dipole moments and static dipole polarizabilities of sodium clusters00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38425]], camposKey:1932-7447 2011-07-14 Stepwise Melting in Na-41(+): A First-Principles Critical Analysis of Available Experimental Results1318013186, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38454]], camposKey:0021-9606 2011-04-28 First-principles determination of the structure of Na-N and Na-N(-) clusters with up to 80 atoms00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38452]], camposKey:0021-9606 2011-01-01 Identifying structural and energetic trends in isovalent core-shell nanoalloys as a function of composition and size mismatch111, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38424]], camposKey:0066-426X 2011-01-01 Melting and Freezing of Metal Clusters151172, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38464]], camposKey:0002-7863 2010-09-22 Activation of Dinitrogen by Solid and Liquid Aluminum Nanoclusters: A Combined Experimental and Theoretical Study1290612918, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38455]], camposKey:0021-9606 2010-03-14 Photoelectron spectroscopy of cold aluminum cluster anions: Comparison with density functional theory results00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38451]], camposKey:0021-9606 2010-01-01 Structure determination in 55-atom Li-Na and Na-K nanoalloys00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38437]], camposKey:0021-9606 2009-11-28 Structural and electronic properties of oxidized sodium clusters: A combined photoelectron and density functional study00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=3966]], camposKey:1434-6060 2009-04-01 European Physical Journal D: Preface00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38460]], camposKey:0031-9007 2009-01-30 Premelting and Postmelting in Clusters00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38442]], camposKey:1098-0121 2009-01-01 Atomic layering and related postmelting effects in small liquid metal clusters14, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38463]], camposKey:0021-9606 2009-01-01 Electronic effects on melting: Comparison of aluminum cluster anions and cations111, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38441]], camposKey:0021-9606 2009-01-01 Structures and stabilities of Al-n(+), Al-n, and Al-n(-) (n=13-34) clusters00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38465]], camposKey:1380-7323 2008-05-29 Chapter 3 Computer simulation of the solid-liquid phase transition in alkali metal nanoparticles5983, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38461]], camposKey:0021-9606 2008-01-01 Correlation between the latent heats and cohesive energies of metal clusters110, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38456]], camposKey:0031-9007 2008-01-01 Melting-point depression by insoluble impurities: A finite size effect00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38458]], camposKey:0021-9606 2008-01-01 Substituting a copper atom modifies the melting of aluminum clusters00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38457]], camposKey:1434-6060 2007-07-01 Geometric magic numbers of sodium clusters: Interpretation of the melting behaviour5760, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=54843]], camposKey:1380-7323 2007-01-01 Computer simulation of the solid-liquid phase transition in alkali metal nanoparticles5983, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38466]], camposKey:1472-7978 2007-01-01 Melting transition in rotating sodium clusters339353, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38438]], camposKey:0166-1280 2006-10-12 From first-principles to material properties918, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38445]], camposKey:1520-6106 2006-07-27 First-principles structures and stabilities of Al-N(+) (N= 46-62) clusters1402014023, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38443]], camposKey:0927-0256 2006-03-01 Molecular dynamics simulation of the melting-like transition in K1Na54174178, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38439]], camposKey:1098-0121 2006-01-01 Small sodium clusters that melt gradually: Melting mechanisms in Na-30111, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38429]], camposKey:1520-6106 2005-07-14 Competing thermal activation mechanisms in the meltinglike transition of Na-N (N=135-147) clusters1304313048, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=40627]], camposKey:0016-7037 2005-05-01 Development of transferable interatomic potentials for oxides and silicates using DFT calculations00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38436]], camposKey:0031-9007 2005-01-01 Anomalous size dependence in the melting temperatures of free sodium clusters: An explanation for the calorimetry experiments00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38446]], camposKey:1549-9618 2005-01-01 Melting-like transition in a ternary alkali nanoalloy: Li13Na30Cs12299306, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38447]], camposKey:2469-9950 2005-01-01 Molecular dynamics simulations of the meltinglike transition in Li13Na42 and Na13Cs42 clusters112, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=18167]], camposKey:0031-9007 2005-01-01 New Insights into the Melting Behavior of MgO from Molecular Dynamics Simulations: The Importance of Premelting Effects685010, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38449]], camposKey:1098-0121 2005-01-01 Structural and thermal behavior of compact core-shell nanoparticles: Core instabilities and dynamic contributions to surface thermal stability00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38430]], camposKey:1098-0121 2004-12-01 Fully transferable interatomic potentials for large-scale computer simulations of simple metal oxides: Application to MgO00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38462]], camposKey:1520-6106 2004-01-01 Thermal properties of impurity-doped clusters: Orbital-free molecular dynamics simulations of the meltinglike transition in Li1Na54 and Cs1Na541172211731, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38434]], camposKey:1098-0121 2003-06-01 First-principles study of elastic properties and pressure-induced phase transitions of Sn: LDA versus GGA results00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38426]], camposKey:0021-9606 2003-04-01 Interionic potentials from ab initio molecular dynamics: The alkaline earth oxides CaO, SrO, and BaO57045717, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38433]], camposKey:0021-9606 2003-04-01 Oxide potentials from ab initio molecular dynamics: An assessment of their transferability57185728, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38428]], camposKey:0021-9606 2003-01-01 Comment on "The cohesive energetics of solid cesium chloride" [J. Chem. Phys. 118, 2308 (2003)]87658766, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38431]], camposKey:0021-9606 2003-01-01 Ewald summation of electrostatic multipole interactions up to the quadrupolar level74717483, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38432]], camposKey:1364-5498 2003-01-01 Multipoles and interaction potentials in ionic materials from planewave-DFT calculations171184, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38416]], camposKey:0021-9606 2002-10-22 Molecular dynamics simulations of the liquid-vapor interface of a molten salt. III. Size asymmetry effects and binary mixtures76597668, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38415]], camposKey:0009-2614 2002-04-26 A transferable interatomic potential for MgO from ab initio molecular dynamics437444, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38411]], camposKey:1520-6106 2002-01-01 Lattice distortions induced by As3+, Sb3+, and Bi3+ substitutional impurities in KCl: An embedded cluster study69916996, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38414]], camposKey:0370-1972 2002-01-01 Quantum mechanical study of the lattice distortions induced by aliovalent Pb2+ impurities in alkali halides13351347, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38419]], camposKey:0021-9606 2001-11-01 Molecular dynamics simulations of the liquid-vapor interface of a molten salt. I. Influence of the interaction potential86038611, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38421]], camposKey:0021-9606 2001-11-01 Molecular dynamics simulations of the liquid-vapor interface of a molten salt. II. Finite size effects and comparison to experiment86128619, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38417]], camposKey:0953-8984 2001-09-03 Local structures and relative stabilities of Tl+-dimer substitutional impurity centres in NaI and KI80158029, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38420]], camposKey:1520-6106 2001-01-01 An ab initio study of the lattice distortions induced by nonisovalent Ge2+, Sn2+, and Pb2+ substitutional impurities in crystalline NaCl52565263, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38413]], camposKey:1089-5647 2001-01-01 An ab initio study of the structures and relative stabilities of doubly charged [(NaCl)(m)(Na)(2)](2+) cluster ions27612765, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1771]], camposKey:1434-6060 2001-01-01 Melting behavior of large disordered sodium clusters221227, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1717]], camposKey:1520-6106 2001-01-01 Melting in large sodium clusters: An orbital-free molecular dynamics study23862392, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=40628]], camposKey:2469-9950 2001-01-01 Orbital-free molecular dynamics study of melting in K-20, K-55, K-92, K-142, Rb-55, and Cs-55 clusters00, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1713]], camposKey:1098-0121 2000-01-01 Ab initio calculation of the lattice distortions induced by substitutional Ag- and Cu- impurities in alkali halide crystals30863092, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38469]], camposKey:0163-1829 2000-01-01 Emergence of bulk CsCl structure in (CsCl)nCs+ cluster ions1368713691, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38418]], camposKey:0021-9606 2000-01-01 Ga+, In+, and Tl+ impurities in alkali halide crystals: Distortion trends86808685, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38448]], camposKey:1520-6106 2000-01-01 Structures and stabilities of CaO and MgO clusters and cluster ions: An alternative interpretation of the experimental mass spectra83988405, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1744]], camposKey:0031-9015 1999-01-01 Calculation of the band gap energy and study of cross luminescence in alkaline-earth dihalide crystals28292835, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1724]], camposKey:0021-9606 1999-01-01 Orbital-free molecular dynamics simulations of melting in Na-8 and Na-20: Melting in steps60266035, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38459]], camposKey:0021-9606 1999-01-01 Structures and stabilities of doubly charged (MgO)(n)Mg2+ (n=1-29) cluster ions47884796, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=7457]], camposKey:1098-0121 1998-01-01 Ab initio calculations of structures and stabilities of (NaI)(n)Na+ and (CsI)(n)Cs+ cluster ions99729979, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=3981]], camposKey:0035-001X 1998-01-01 Calculation of the band gap energy of ionic crystals550558, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38471]], camposKey:2469-9950 1998-01-01 Lattice Distortions Around a Tl+ Impurity in NaI:Tl+ and CsI:Tl+ Scintillators. An Ab Initio Study Involving Large Active Clusters1196411969, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=38440]], camposKey:1098-0121 1997-01-01 Structural and electronic properties of small neutral (MgO)(n) clusters76077614, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1747]], camposKey:1098-0121 1997-01-01 Structure and bonding in small neutral alkali halide clusters1535315360, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=1715]], camposKey:1089-5647 1997-01-01 Theoretical study of small (NaI)(n) clusters59445950, com.sigma.fs3.argos.domain.gpc.GpcArticlesRev[id=com.sigma.fs3.argos.domain.gpc.GpcArticlesRevPK[ifcactivitat=ARE, ifccomptador=6581]], camposKey:0022-2852 1996-01-01 The microwave spectrum of 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Alvarez-Zapatero P.; Lebon A.; Aguilera del Toro R.H.; Aguado A.; Vega A. Why are Zn-rich Zn-Mg nanoalloys optimal protective coatings against corrosion? A first-principles study of the initial stages of the oxidation process . PHYSICAL CHEMISTRY CHEMICAL PHYSICS 2021; 23(43): 24685-24698.

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Aguado A.; Gonzalez D.J.; Gonzalez L.E.; Lopez J.M.; Nuñez S.; Stott M.J. An Orbital Free ab initio Method: Applications to Liquid Metals and Clusters. En: Wesolowski, Tomasz A; Wang, Yan Alexander. Recent Progress in Orbital-free Density Functional Theory. World Scientific; 2013. p. 55-145.

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ESTUDIO DE PRIMEROS PRINCIPIOS DE LAS PROPIEDADES ESTRUCTURALES Y ELECTRÓNICAS DE NANOMATERIALES Y SU REACTIVIDAD EN EL CONTEXTO DE VARIAS ÁREAS TECNOLÓGICAS. Equipo Investigadores: GONZALEZ TESEDO, LUIS ENRIQUE (IP); VEGA HIERRO, ANDRES (IP); GONZALEZ FERNANDEZ, DAVID JOSE; CABRIA ALVARO, IVAN; TORRES CABRERA, MARIA BEGOÑA; AGUADO RODRIGUEZ, ANDRES. Equipo de Trabajo: LEBON , ALEXANDRE; GONZALEZ DEL RIO, BEATRIZ; AGUILERA DEL TORO, RODRIGO HUMBERTO; VINUESA SANZ, GUILLERMO; ALVAREZ ZAPATERO, PABLO. PGC2018-093745-B-I00. Entidades Participantes: UNIVERSIDAD DE VALLADOLID (UVa). Entidades Financiadoras: AGENCIA ESTATAL DE INVESTIGACIÓN, FONDOS FEDER. 01/01/2019-31/12/2022

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CONTRATO POSDOCTORAL RAMÓN Y CAJAL DE ANDRÉS AGUADO RODRÍGUEZ: SIMULACIÓN DE NANOMATERIALES Y MATERIALES EXTENSOS A NIVEL DE PRIMEROS PRINCIPIOS.. AGUADO RODRIGUEZ, ANDRES (Director). AGUADO RODRIGUEZ, ANDRES (Beneficiario). 01/02/2003 - 17/12/2007. 180.007,74 EUR.

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AYUDAS UVA A LA INVESTIGACION: POSTER: STRUCTURE AND MELTING-LIKE TRANSITION IN SODIUM AND ALUMINIUM CLUSTERS, DAVOS ( SUIZA ) 20/03/2011 -
(Asistencia). AGUADO RODRIGUEZ, ANDRES. AYUDAS UVA A LA INVESTIGACION: POSTER: STRUCTURE AND MELTING-LIKE TRANSITION IN SODIUM AND ALUMINIUM CLUSTERS
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Diseño de un proceso de evaluación coherente con el EEES para la asignatura Mecánica Cuántica del Grado en Física - PID2014/37. Universidad de Valladolid. 01/09/2014.
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