A. Solé

发表

The reaction between HO and (H2O)n (n = 1, 3) clusters: reaction mechanisms and tunneling effects

J. M. Bofill, R. Crehuet, X. Giménez, 2011 .

Unexpected reactivity of amidogen radical in the gas phase degradation of nitric acid.

S. Olivella, J. Anglada, A. Solé, 2014, Journal of the American Chemical Society.

Tropospheric oxidation of methyl hydrotrioxide (CH3OOOH) by hydroxyl radical.

J. Anglada, A. Solé, 2018, Physical chemistry chemical physics : PCCP.

Unimolecular Isomerizations and Oxygen Atom Loss in Formaldehyde and Acetaldehyde Carbonyl Oxides. A Theoretical Investigation

J. M. Bofill, S. Olivella, J. Anglada, 1996 .

Dynamical study of the collinear C(3P) + HF(1Σ+)→CF(2Π) + H(2S) reaction

A. Aguilar, J. Lucas, A. Solé, 1988 .

HBO osculating complex in the B(2P)+ OH(2Π) reaction

M. Albertí, A. Aguilar, A. Solé, 1991 .

B(2P)+ H2O (X 1A1): a quasi-classical 3D trajectory calculation

M. Albertí, A. Aguilar, R. Sayós, 1991 .

Ab initio mechanistic studies of radical reactions. Addition of methyl radical to acetylene and ethylene

V. Barone, S. Olivella, R. Arnaud, 1985 .

Mechanism of the hydrogen transfer from the OH group to oxygen-centered radicals: proton-coupled electron-transfer versus radical hydrogen abstraction.

J. M. Bofill, S. Olivella, J. Anglada, 2004, Chemistry.

Reaction time and acoustic startle in normal human subjects

J. Valls-Solé, E. Muñoz, F. Valldeoriola, 1995, Neuroscience Letters.

Photochemical rearrangements of norbornadiene Pauson-Khand cycloadducts.

A. Riera, S. Olivella, J. Benet‐Buchholz, 2007, Angewandte Chemie.

Photochemical Rearrangements of Norbornadiene Pauson—Khand Cycloadducts.

A. Riera, S. Olivella, J. Benet‐Buchholz, 2007 .

Thermal and photochemical rearrangement of bicyclo[3.1.0]hex-3-en-2-one to the ketonic tautomer of phenol. Computational evidence for the formation of a diradical rather than a zwitterionic intermediate.

A. Riera, S. Olivella, M. Reguero, 2002, Journal of the American Chemical Society.

Ab Initio Calculations of the Potential Surface for the Thermal Decomposition of the Phenoxyl Radical

S. Olivella, A. García-Raso, A. Solé, 1995 .

Small-ring cyclic alkynes: ab initio molecular orbital study of 1,4-dioxacyclohexyne (p-dioxyne)

A. Riera, S. Olivella, M. A. Pericàs, 1987 .

THEORETICAL ANALYSIS OF THE UNIMOLECULAR GAS-PHASE DECOMPOSITIONS OF THE PROPANE MOLECULAR ION

D. McAdoo, S. Olivella, A. Solé, 1998 .

Unimolecular Decompositions of Ionized Isopropyl Methyl Ether: An ab Initio and RRKM Study

D. McAdoo, S. Olivella, A. Solé, 1995 .

Unimolecular Reactions of Ionized Alkanes: Theoretical Study of the Potential Energy Surface for CH3.bul. and CH4 Losses from Ionized Butane and Isobutane

D. McAdoo, S. Olivella, A. Solé, 1994 .

Potential energy curves for the HeAr+ and NeAr+ ions

B. Brunetti, F. Vecchiocattivi, A. Solé, 1986 .

Unimolecular Decomposition of β-Hydroxyethylperoxy Radicals in the HO•-Initiated Oxidation of Ethene: A Theoretical Study

S. Olivella, A. Solé, 2004 .

Attempted generation and structure of the 4-(1,2,4-triazoyl) cation

S. Olivella, R. Abramovitch, A. Solé, 1994 .

The gas phase oxidation of HCOOH by Cl and NH2 radicals. Proton coupled electron transfer versus hydrogen atom transfer*

R. Crehuet, J. Anglada, A. Solé, 2019, Molecular Physics.

Atmospheric formation of the NO3 radical from gas-phase reaction of HNO3 acid with the NH2 radical: proton-coupled electron-transfer versus hydrogen atom transfer mechanisms.

S. Olivella, J. Anglada, A. Solé, 2014, Physical chemistry chemical physics : PCCP.

Crossed molecular beams study of the M+(1S)+Na(3 2S)→M+(1S)+Na(3 2P) collision systems (M+=Li+, Na+, K+, Cs+) in the 0.05–3.00 keV energy range

M. Albertí, A. Aguilar, R. Sayós, 1994 .

Molecular and electronic structure of the low-lying electronic states of cycloalkenylidenes: cyclopropenylidene

J. M. Bofill, S. Olivella, J. Vilarrasa, 1988 .

Substituent Effects on the Low‐Lying Singlet and Triplet States of Methylene

S. Olivella, J. Vilarrasa, A. Solé, 1986 .

The Atmospheric Oxidation of HONO by OH, Cl, and ClO Radicals.

J. Anglada, A. Solé, 2017, The journal of physical chemistry. A.

The reaction of formaldehyde carbonyl oxide with the methyl peroxy radical and its relevance in the chemistry of the atmosphere.

S. Olivella, J. Anglada, A. Solé, 2013, Physical chemistry chemical physics : PCCP.

Impact of the water dimer on the atmospheric reactivity of carbonyl oxides.

J. Anglada, A. Solé, 2016, Physical chemistry chemical physics : PCCP.

Hydrogen transfer between sulfuric acid and hydroxyl radical in the gas phase: competition among hydrogen atom transfer, proton-coupled electron-transfer, and double proton transfer.

S. Olivella, J. Anglada, A. Solé, 2006, The journal of physical chemistry. A.

Mechanisms for the Reactions of Hydroxyl Radicals with Acrolein: A Theoretical Study.

S. Olivella, A. Solé, 2008, Journal of chemical theory and computation.

Mechanism of 1,3-migration in allylperoxyl radicals: computational evidence for the formation of a loosely bound radical-dioxygen complex.

S. Olivella, A. Solé, 2003, Journal of the American Chemical Society.

New insight into the gas-phase bimolecular self-reaction of the HOO radical.

S. Olivella, J. Anglada, A. Solé, 2007, Journal of Physical Chemistry A.

On the Dissociation of Ground State trans-HOOO Radical: A Theoretical Study.

S. Olivella, J. Anglada, A. Solé, 2010, Journal of chemical theory and computation.

Ab Initio Calculations on the 5-exo versus 6-endo Cyclization of 1,3-Hexadiene-5-yn-1-yl Radical: Formation of the First Aromatic Ring in Hydrocarbon Combustion

A. Solé, †‡ and Santiago Olivella, 2000 .

A theoretical investigation of the thermal ring opening of cyclopropyl radical into allyl radical. Evidence for a highly nonsymmetric transition state

Josep Maria Bofill, Albert Solé, Santiago Olivella, 1990 .

Unexpected reactivity of amidogen radical in the gas phase degradation of nitric acid.

S. Olivella, J. Anglada, A. Solé, 2014, Journal of the American Chemical Society.

Kinetic interpretation of aromaticity: a theoretical study

J. M. Bofill, S. Olivella, A. Solé, 1988 .