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Judith Millán

Ab initioground potential energy surface, VTST and QCT study of the O(3P)+CH4(X 1A1)→OH(X 2Π)+CH3(X 2A2″) reaction
1999 · Miguel González, Jordi Hernando, et al. · The Journal of Chemical Physics · 75
Ab initio potential energy surface, variational transition state theory, and quasiclassical trajectory studies of the F+CH4→HF+CH3 reaction
2004 · Diego Troya, Judith Millán, et al. · The Journal of Chemical Physics · 49
Ab initio analytical potential energy surface and quasiclassical trajectory study of the O+(4S)+H2(X 1Σg+)→OH+(X 3Σ−)+H(2S) reaction and isotopic variants
2004 · Rodrigo Martı́nez, Judith Millán, et al. · The Journal of Chemical Physics · 45
Unravelling Protein–DNA Interactions at Molecular Level: A DFT and NCI Study
2016 · J. González, I. Baños, et al. · Journal of Chemical Theory and Computation · 44
Exploring microsolvation of the anesthetic propofol
2012 · Iker Leon, Emilio J. Cocinero, et al. · Physical Chemistry Chemical Physics · 43
Ab initio , kinetics, and dynamics study of Cl+CH4→HCl+CH3
2002 · Diego Troya, Judith Millán, et al. · The Journal of Chemical Physics · 43
Shaping Micelles: The Interplay Between Hydrogen Bonds and Dispersive Interactions
2013 · Iker León, Judith Millán, et al. · Angewandte Chemie International Edition · 36
Isomerism of the Aniline Trimer
2018 · Cristóbal Pérez, Iker León, et al. · Angewandte Chemie International Edition · 29
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Mimicking anaesthetic–receptor interaction: a combined spectroscopic and computational study of propofol⋯phenol
2012 · Iker León, Judith Millán, et al. · Physical Chemistry Chemical Physics · 26
A Spectroscopic and Computational Study of Propofol Dimers and Their Hydrated Clusters
2012 · Iker León, Judith Millán, et al. · ChemPhysChem · 25
Exploring Epigenetic Marks by Analysis of Noncovalent Interactions
2020 · Judith Millan, Alberto Lesarri, et al. · ChemBioChem · 23
Water Encapsulation by Nanomicelles
2014 · Iker León, Judith Millán, et al. · Angewandte Chemie International Edition · 22
Ab initio study of the O(1D)+CH4(X 1A1)→OH(X 2Π)+CH3(X 2A2″) reaction: Ground and excited potential energy surfaces
2003 · Jordi Hernando, Judith Millán, et al. · The Journal of Chemical Physics · 22
A combined spectroscopic and theoretical study of propofol·(H2O)3
2012 · Iker León, Emilio J. Cocinero, et al. · The Journal of Chemical Physics · 20
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Calculation of traces ofp-order replacement operators overN-electron spin-adapted spaces
1993 · A. Torre, L. Lain, et al. · Physical Review A · 18
Formation of water polyhedrons in propofol–water clusters
2012 · Iker León, Emilio J. Cocinero, et al. · Physical Chemistry Chemical Physics · 16
Competition between stacked and hydrogen bonded structures of cytosine aggregates
2017 · Jorge González, Imanol Usabiaga, et al. · Physical Chemistry Chemical Physics · 14
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Unraveling the Benzocaine–Receptor Interaction at Molecular Level Using Mass-Resolved Spectroscopy
2013 · Edurne Aguado, Iker León, et al. · The Journal of Physical Chemistry B · 13
Discriminating the structure of exo-2-aminonorbornane using nuclear quadrupole coupling interactions
2011 · Patricia Écija, Emilio J. Cocinero, et al. · The Journal of Chemical Physics · 13
Mimicking anesthetic–receptor interactions in jets: the propofol–isopropanol cluster
2014 · Iker León, Imanol Usabiaga, et al. · Physical Chemistry Chemical Physics · 11
Experimentando con las redes sociales en la enseñanza universitaria en ciencias
2013 · Rodrigo Martínez, Francisco Corzana, et al. · Revista eureka sobre enseñanza y divulgación de las ciencias · 10
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Magic Numbers in the Solvation of the Propofol Dimer
2013 · Iker León, Judith Millán, et al. · ChemPhysChem · 8
Vibrational predissociation of the ND3-Ar Van der Waals complex: Comparison with NH3-Ar
1997 · J. Millan, N. Halberstadt, et al. · The Journal of Chemical Physics · 8
Fragmentation dynamics of the vibrationally excited ammonia–argon van der Waals complex
1995 · J. Millan, N. Halberstadt, et al. · The Journal of Chemical Physics · 8
Isomerism of the Aniline Trimer
2018 · Cristóbal Pérez, Iker León, et al. · Angewandte Chemie · 7
Works count: 48
Citation count: 689
H-index: 16
I10-index: 21
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