J. Alvariño

发表

Dynamics of the D+ + H2 and H+ + D2 reactions: a detailed comparison between theory and experiment.

M. Hankel, F. J. Aoiz, D. Gerlich, 2012, Physical chemistry chemical physics : PCCP.

Energy dependent dynamics of the O(1D) + HCl reaction: a quantum, quasiclassical and statistical study.

S. C. Smith, M. Hankel, F. J. Aoiz, 2011, Physical chemistry chemical physics : PCCP.

Reaction dynamics of the D+ + H2 system. A comparison of theoretical approaches.

F. J. Aoiz, V. Herrero, P. G. Jambrina, 2010, Physical chemistry chemical physics : PCCP.

Elucidation of the O(1D) + HF → F + OH mechanism by means of quasiclassical trajectories.

F. J. Aoiz, P. G. Jambrina, J. Aldegunde, 2012, Physical chemistry chemical physics : PCCP.

Quasiclassical trajectory simulation of the O(1D)+HCl→OH+Cl, ClO+H reactions on an improved potential energy surface

A. Laganà, F. J. Aoiz, M. Menéndez, 2000 .

A detailed study of the dynamics of the O(1D)+HCl→OH+Cl,ClO+H reactions

F. J. Aoiz, J. Alvariño, V. Rábanos, 2003 .

The dynamics of the O(1D) + HCl --> OH + Cl reaction at a 0.26 eV collision energy: a comparison between theory and experiment.

F. J. Aoiz, P. G. Jambrina, M. Menéndez, 2009, The journal of physical chemistry. A.

Quasi-classical versus quantum calculations for the collinear Li + FH reaction

A. Laganà, J. Alvariño, M. Hernandez, 1984 .

Exact quantum stereodynamics: The steric effect for the Li+HF→LiF+H reaction

V. Aquilanti, A. Laganà, J. Alvariño, 1997 .

Quantum stereodynamics of the F + H2 → HF + H reaction by the stereodirected S-matrix approach

V. Aquilanti, G. Grossi, J. Aldegunde, 2004 .

Computational derivation of coexistence curves for van-der-Waals-type equations

J. Alvariño, S. Velasco, L. Quintales, 1988 .

Double-well structure and microscopic branching in the reaction

A. Laganà, J. Alvariño, M. L. Hernández, 1999 .

The B(1∑+) and X(1∑+) States of HF and DF: RKR Curves and Franck-Condon Factors

J. Alvariño, M. L. Hernández, L. González, 1983 .

Accurate and model collinear reactive probabilities of the Mg+FH reaction

M. Paniagua, A. Laganà, J. Alvariño, 1990 .

Selective tunnelling effects in collinear chemical reactions

A. Laganà, J. Alvariño, M. Hernandez, 1985 .

potential-energy surfaces

O. Roncero, J. Alvariño, Susana Gómez-Carrascoa, 2005 .

DEPENDENCE OF CALCULATED PRODUCT ROTATIONAL POLARIZATIONS ON THE SCATTERING ANGLE FOR THE O(1D) + HCL REACTION

A. Laganà, J. Alvariño, A. Bolloni, 1998 .

Energy mode effectiveness and tunnelling in triatomic reactions: the energy threshold for the Mg + FH → MgF + H reaction

M. Albertí, A. Aguilar, X. Giménez, 1998 .

Quantum state to state reactive probabilities: The H(D) + Cl2(v) → H(D)CI(v′) + Cl reactions

A. Laganà, J. Alvariño, 1983 .

Two-configuration mc potential energy surface for the reaction of Mg with HF

M. Paniagua, A. Laganà, J. D. L. Vega, 1986 .

Potential energy surface for collinear Mg + FH → MgF + H reaction

M. Paniagua, A. Laganà, J. D. L. Vega, 1985 .

Calculated vs measured scattering and kinetic data for the Li+HCl reaction

Ernesto Garcia, A. Laganà, J. Alvariño, 1990 .

Direct versus resonances mediated F+OH collisions on a new 3A" potential energy surface.

O. Roncero, M. Paniagua, A. Aguado, 2004, The Journal of chemical physics.

The kinetics of anionic polymerization of styrene in 1,2‐dimethoxiethane

J. Alvariño, G. V. Schulz, B. J. Schmitt, 2007 .

The charge‐transfer complex maleic anhydride‐tetrahydrofuran and its role as photosensitizer in the polymerization of methyl methacrylate

F. Castaño, J. Alvariño, Amélia H. U. Torres, 1978 .

The competition of Penning ionization and ion pair formation in fast collisions of metastable rare gas atoms with O2 and Cl2 molecules

V. Kempter, J. Alvariño, B. Staudenmayer, 1984 .

Ion pair formation in fast collisions of Ar*(3P2,0) with O2 molecules

V. Kempter, J. Alvariño, T. Beckert, 1981 .

Transition state dynamics of OHF on several electronic states: photodetachment spectrum of OHF- and conical intersections.

O. Roncero, M. Paniagua, A. Aguado, 2004, The Journal of chemical physics.

Photodetachment spectrum of OHF-: three-dimensional study of the heavy-light-heavy resonances.

O. Roncero, M. Paniagua, A. Aguado, 2004, The Journal of chemical physics.

Dynamics and kinetics of the F + OH reaction on the ground triplet potential energy surface

O. Roncero, M. Paniagua, A. Aguado, 2004 .

Analysis of the H + D2 reaction mechanism through consideration of the intrinsic reactant polarisation.

F. J. Aoiz, J. Aldegunde, M. P. de Miranda, 2006, Physical chemistry chemical physics : PCCP.

Quantum stereodynamics of the F+OH(v, j) reactive collision on the 13 A″ state

M. Paniagua, A. Aguado, L. González-Sánchez, 2004 .

Two‐vector correlations and microscopic branching in chemical dynamics: Alignment and orientation effects for the Mg+HF→MgF+H reaction

A. Laganà, J. Alvariño, 1991 .

Macroscopic indicators for microscopic branching: The Be+HF→BeF+H chemical reaction

A. Laganà, J. Alvariño, 1990 .

Competing mechanisms and products’ properties for the Be+HF reaction

A. Laganà, J. Alvariño, M. L. Hernández, 1990 .

RHF potential energy surface for the collinear reaction of Na with HF

M. Paniagua, A. Laganà, J. D. L. Vega, 1986 .

F+OH reactive collisions on new excited 3A" and 3A' potential-energy surfaces.

O. Roncero, M. Paniagua, A. Aguado, 2005, The Journal of chemical physics.

Franck-Condon factors and R-centroids for the A1∑+-X1∑+ and B3Π(0+)−X1∑+ band system of 63Cu1H and 63Cu2H

J. Alvariño, E. Martinez, E. G. Para, 1983 .

Rotational energy enhancement of the reaction of Be with HF

A. Laganà, J. Alvariño, 1988 .

Quasiclassical trajectory calculations of the thermal rate coefficient for the oxygen atom + hydroxyl .fwdarw. oxygen + hydrogen atom reaction on realistic double many-body expansion potential energy surfaces for ground-state hydroperoxy

A. Varandas, J. Alvariño, L. Quintales, 1988 .

On the features of statistical behaviour of the O(3P)+HCl(v = 2, j = 1,6,9) → OH + Cl reaction

T. González-Lezana, J. Alvariño, P. Bargueño, 2008 .

Direct versus indirect microscopic mechanisms in the Li HF reaction

A. Laganà, J. Alvariño, F. Basterrechea, 1986 .

Mechanism and control of the F+H2 reaction at low and ultralow collision energies.

F. J. Aoiz, J. Aldegunde, M. P. de Miranda, 2006, The Journal of chemical physics.

An improvement of the Li+HF PES based on a 3D quasiclassical trajectory test

Antonio Laganà, Maria Luz Hernandez, Ernesto Garcia, 1986 .

Quantum and quasiclassical state-selected O(1D) + HF reaction dynamics and kinetics on a new MRCI ground singlet potential energy surface

J. Alvariño, M. L. Hernández, S. Gómez‐Carrasco, 2007 .

Progress in validating the potential energy surface of the OH+H2 reaction: product vibrational distributions

Ernesto Garcia, A. Laganà, J. Alvariño, 2001 .

Orientation effects and reaction mechanisms for the H + ICI reaction

A. Laganà, J. Alvariño, 1987 .

Initial orientation dependence of microscopic and macroscopic branching in H + ICI→ HI + CI, HCI + I chemical reactions

J. Alvariño, L. Quintales, 1986 .

Precipitation chromatography fractionation: The effect of the ratio support weight/sample size

J. Alvariño, M. L. Hernández, A. Torre, 1978 .

Stereodynamics from the Stereodirected Representation of the Exact QuantumSMatrix: The Li + HF → LiF + H Reaction

Vincenzo Aquilanti, Stefano Crocchianti, V. Aquilanti, 1998 .

Polymerization kinetics of isoprene initiated by 1,1′-diphenyl-n-hexyl-lithium

J. Alvariño, G. M. Guzmán, A. Bello, 1972 .

Structure of the ionic species in organosodium compounds dissolved in n-electron donor, low dielectric constant media

J. Alvariño, 1975 .

Ab initio calculation and quasi‐classical dynamics study of the two lowest potential energy surfaces of the O(1D)+HBr system*

M. Rosi, A. Laganà, J. Alvariño, 2002 .

Ab initio calculations and dynamical tests of a potential energy surface for the Na + FH reaction

Antonio Laganà, Paolo Palmieri, Ernesto Garcia, 1997 .

A quantum mechanical collinear study of the reactions Li + FX → LiF + X (X = H, D, T)

A. Laganà, J. Alvariño, O. Gervasi, 1982 .

Dynamics of the D + + H 2 and H + + D 2 reactions : a detailed comparison between theory and experiment

M. Hankel, D. Gerlich, V. Herrero, 2013 .

A quasiclassical trajectory test for a potential energy surface of the Li+HF reaction

Antonio Laganà, Osvaldo Gervasi, Piergiorgio Casavecchia, 1982 .