F J Aoiz
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Explore the profile of F J Aoiz including associated specialties, affiliations and a list of published articles.
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Articles
104
Citations
170
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Recent Articles
1.
Saez-Rabanos V, Saez-Cano G, Verdasco J, Aoiz F, Herrero V
Phys Chem Chem Phys
. 2024 Dec;
27(1):376-387.
PMID: 39641746
A detailed analysis of the low collision energy (0.03-10 meV) integral reaction cross-section has been carried out for the F + HD ( = 0, 1; = 1)→ HF(DF) +...
2.
Jambrina P, Croft J, Balakrishnan N, Guo H, Aoiz F
Faraday Discuss
. 2024 Jun;
251(0):104-124.
PMID: 38836438
In molecular dynamics, a fundamental question is how the outcome of a collision depends on the relative orientation of the collision partners before their interaction begins (the stereodynamics of the...
3.
Veselinova A, Menendez M, Gonzalez-Sanchez L, Zanchet A, Aoiz F, Jambrina P
Phys Chem Chem Phys
. 2024 Feb;
26(8):6752-6762.
PMID: 38323460
The O(P) + D → OD(Π) + D reaction presents the peculiarity of taking place on two different potential energy surfaces (PESs) of different symmetry, A' and A'', which become...
4.
Lara M, Jambrina P, Aoiz F
J Chem Phys
. 2023 May;
158(18).
PMID: 37154275
Reactive and elastic cross sections and rate coefficients have been calculated for the S(1D) + D2(v = 0, j = 0) reaction using a modified hyperspherical quantum reactive scattering method....
5.
Veselinova A, Agundez M, Goicoechea J, Menendez M, Zanchet A, Verdasco E, et al.
Astron Astrophys
. 2021 Jul;
648.
PMID: 34257462
The reaction between atomic oxygen and molecular hydrogen is an important one in astrochemistry as it regulates the abundance of the hydroxyl radical and serves to open the chemistry of...
6.
Jambrina P, Lara M, Aoiz F
J Chem Phys
. 2021 Apr;
154(12):124304.
PMID: 33810659
Shape resonances appear when the system is trapped in an internuclear potential well after tunneling through a barrier. They manifest as peaks in the collision energy dependence of the cross...
7.
Saez-Rabanos V, Verdasco J, Aoiz F, Herrero V
Phys Chem Chem Phys
. 2021 Jan;
23(13):8002-8012.
PMID: 33480905
The excitation functions (reaction cross-section as a function of collision energy) of the F + HD(v = 0, 1; j = 0, 1) benchmark system have been calculated in the...
8.
Jambrina P, Gonzalez-Sanchez L, Lara M, Menendez M, Aoiz F
Phys Chem Chem Phys
. 2020 Nov;
22(43):24943-24950.
PMID: 33140788
Scattering resonances are pure quantum effects that appear whenever the collision energy matches the energy of a quasi-bound state of the intermolecular complex. Here we show that rotational quenching of...
9.
Jambrina P, Zanchet A, Menendez M, Herrero V, Aoiz F
Phys Chem Chem Phys
. 2019 Nov;
21(45):25389-25396.
PMID: 31709441
One of the most relevant features of the O(P) + H reaction is that it occurs on two different potential energy surfaces (PESs) of symmetries A' and A'' that correlate...
10.
Menendez M, Jambrina P, Zanchet A, Verdasco E, Suleimanov Y, Aoiz F
J Phys Chem A
. 2019 Aug;
123(37):7920-7931.
PMID: 31461272
In the past decade, ring polymer molecular dynamics (RPMD) has emerged as a very efficient method to determine thermal rate coefficients for a great variety of chemical reactions. This work...