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João Brandão
Observed names:
Brandão, J.,
Brandão, João,
J. Brandao,
J. Brandão,
Joao Brandao
Institution:
University of Algarve
Observed institutions:
Universidad de Valladolid,
Argonne National Laboratory,
Universidad de Salamanca,
Johannes Gutenberg University Mainz,
Centro de Investigacao em Quimica do Algarve,
University of Algarve,
University of Coimbra,
The University of Osaka
show all 8
ORCID:
0000-0003-3047-7793
Observed ORCID:
0000-0003-3047-7793
OpenAlex ID:
A5040975901
Recalibration of a single-valued double many-body expansion potential energy surface for ground-state hydroperoxy and dynamics calculations for the oxygen atom + hydroxyl .fwdarw. oxygen + hydrogen atom reaction
1990
·
M. R. Pastrana
, L. A. M. Quintales
, et al.
·
The Journal of Physical Chemistry
·
252
PDF
Quasiclassical trajectory calculations of the thermal rate coefficients for the reactions H(D)+O2→OH(D)+O and O+OH(D)→O2+H(D) as a function of temperature
1992
·
A. J. C. Varandas
, J. Brandão
, et al.
·
The Journal of Chemical Physics
·
128
A realistic hydroperoxo(~X2A") potential energy surface from the double many-body expansion method
1988
·
A. J. C. Varandas
, J. Brandao
, et al.
·
The Journal of Physical Chemistry
·
87
PDF
A simple semi-empirical approach to the intermolecular potential of van der Waals systems
1982
·
A.J.C. Varandas
, J. Brandão
·
Molecular Physics
·
68
A double many-body expansion of molecular potential energy functions
1986
·
A.J.C. Varandas
, J. Brandão
·
Molecular Physics
·
58
Potential energy surface for H2O(3A″) from accurate ab initio data with inclusion of long-range interactions
2004
·
João Brandão
, César Mogo
, et al.
·
The Journal of Chemical Physics
·
34
Dynamics of the O(P3)+H2 reaction at low temperatures: Comparison of quasiclassical trajectory with quantum scattering calculations
2006
·
P. F. Weck
, N. Balakrishnan
, et al.
·
The Journal of Chemical Physics
·
30
Theoretical studies on the O(3P) + H2→ OH + H reaction
2005
·
Wenli Wang
, Carla Rosa
, et al.
·
Chemical Physics Letters
·
28
Double-valued potential energy surface for H2O derived from accurate ab initio data and including long-range interactions
2003
·
João Brandão
, Carolina M. A. Rio
·
The Journal of Chemical Physics
·
25
Quasiclassical and capture studies on the O (1D)+H2→OH+H reaction using a new potential energy surface for H2O
2003
·
João Brandão
, Carolina M.A. Rio
·
Chemical Physics Letters
·
20
Accurate diatomic curves for Ne 2 , Ar 2 , Kr 2 and Xe 2 form the extended Hartree–Fock approximate correlation energy model
1989
·
José Dias da Silva
, João Brandão
, et al.
·
Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics
·
19
Long-range interactions within the molecule
2003
·
João Brandão
, Carolina M.A. Rio
·
Chemical Physics Letters
·
16
Dynamical studies and product analysis of O( 1 D) + H 2 /D 2 reactions
2007
·
Carolina M. A. Rio
, Joao Brandao
·
Molecular Physics
·
13
PDF
A modified potential for HO2 with spectroscopic accuracy
2009
·
João Brandão
, Carolina M. A. Rio
, et al.
·
The Journal of Chemical Physics
·
10
A full dimensional potential for H 2 O 2 (X 1 A) covering all dissociation channels
2016
·
Daniela V. Coelho
, João Brandão
·
Physical Chemistry Chemical Physics
·
9
Modelling tunnelling effects in multidimensional quasiclassical trajectories. Application to the O(3P) + H2 reaction
2008
·
Carla Rosa
, João Brandão
·
Chemical Physics Letters
·
9
The branching ratio of the O(1D) + HD reaction: A dynamical study
2006
·
Carolina M.A. Rio
, João Brandão
·
Chemical Physics Letters
·
7
Theoretical rate coefficients for the exchange reaction OH+D→OD+H
2006
·
Wenli Wang
, Emanuel Santos
, et al.
·
The Journal of Chemical Physics
·
7
Application to large systems: general discussion
2016
·
Stuart Althorpe
, Gonzalo Angulo
, et al.
·
Faraday Discussions
·
6
Using the Reactions O+H2 → OH+H to Explore the Importance of the Atomic Quantum States on Chemical Kinetics and Reaction Dynamics
2015
·
João Brandão
, Wenli Wang
, et al.
·
Universal Journal of Chemistry
·
5
PDF
Experimental and theoretical studies of the gas-phase reactions of O( 1 D) with H 2 O and D 2 O at low temperature
2021
·
Kevin M. Hickson
, Somnath Bhowmick
, et al.
·
Physical Chemistry Chemical Physics
·
4
PDF
Theory of Gas Phase Scattering and Reactivity for Astrochemistry
2016
·
Wiesenfeld, Laurent
, Thi, Wing-Fai
, et al.
·
HAL
·
4
PDF
The READY program: Building a global potential energy surface and reactive dynamic simulations for the hydrogen combustion
2014
·
César Mogo
, João Brandão
·
Journal of Computational Chemistry
·
4
Quasiclassical study of a termolecular reaction: Application to the HO2 collisional stabilization process
2022
·
César Mogo
, João Brandão
, et al.
·
Computational and Theoretical Chemistry
·
3
Fundamentals: general discussion
2016
·
Stuart C. Althorpe
, Vijay Beniwal
, et al.
·
Faraday Discussions
·
3
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Works count:
40
Citation count:
859
H-index:
13
I10-index:
14
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