AMAIA
SARACIBAR RUIZ DE OCENDA
PROFESORADO AGREGADO
ERNESTO
GARCIA PARA
PROFESORADO CATEDRATICO/A DE UNIVERSIDAD
Publicaciones en las que colabora con ERNESTO GARCIA PARA (15)
2011
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An extension of the molecular simulator GEMS to calculate the signal of crossed beam experiments
Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)
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Capture and dissociation in the complex-forming CH(v = 0,1) + D2→ CHD + D, CD2 + H, CD + HD reactions and comparison with CH(v = 0,1) + H2
Physical Chemistry Chemical Physics, Vol. 13, Núm. 30, pp. 13638-13644
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Capture and dissociation in the complex-forming CH+H2→ CH2+H, CH+H2 reactions
Physical Chemistry Chemical Physics, Vol. 13, Núm. 8, pp. 3421-3428
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On the anomaly of the quasiclassical product distributions of the OH + CO → H + CO2 reaction
Theoretical Chemistry Accounts, Vol. 128, Núm. 4, pp. 727-734
2009
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A comparison of the quantum state-specific efficiency of N + N2 reaction computed on different potential energy surfaces
Physical Chemistry Chemical Physics, Vol. 11, Núm. 11, pp. 1752-1757
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A detailed comparison of centrifugal sudden and J-shift estimates of the reactive properties of the N + N2 reaction
Physical Chemistry Chemical Physics, Vol. 11, Núm. 48, pp. 11456-11462
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Effect of the total angular momentum on the dynamics of the H 2+H2 system
Journal of Physical Chemistry A, Vol. 113, Núm. 52, pp. 14312-14320
2008
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Grid computing in time-dependent quantum reactive dynamics
Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)
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Modeling the global potential energy surface of the N + N2 reaction from ab initio data
Physical Chemistry Chemical Physics, Vol. 10, Núm. 18, pp. 2552-2558
2007
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A detailed trajectory study of the OH + CO → H + CO2 reaction
Chemical Physics, Vol. 332, Núm. 2-3, pp. 162-175
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The shape of the potential energy surface and the thermal rate coefficients of the N + N2 reaction
Journal of Physical Chemistry A, Vol. 111, Núm. 41, pp. 10362-10368
2006
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Calculated versus measured product distributions of the OH+D2 reaction
Molecular Physics, Vol. 104, Núm. 5-7, pp. 839-846
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Theoretical study of the complex-forming CH + H 2 → CH 2 + H reaction
Journal of Physical Chemistry A, Vol. 110, Núm. 16, pp. 5542-5548
2005
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A multiproperty analysis of the OH + H2(D2,HD) potential energy surface
Chemical Physics, Vol. 308, Núm. 3 SPEC.ISS., pp. 201-210
2004
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A full dimensional quasiclassical trajectory study of Cl + CH4 rate coefficients
Journal of Physical Chemistry A, Vol. 108, Núm. 41, pp. 8752-8758