Stereodynamic control of cold rotationally inelastic CO + HD collisions Stereodynamic control of cold rotationally inelastic CO + HD collisions Authors: P. G. Jambrina, J. F. E. Croft, N. Balakrishnan, F. J. Aoiz Ref. Phys. Chem. Chem. Phys. 23, 19364-19374 (2021) https://doi.org/10.1039/D1CP02755G
Quantum study of reaction O(3P) +H2(v,j) -> OH + H: OH formation in strongly UV-irradiated gas Quantum study of reaction O(3P) +H2(v,j) -> OH + H: OH formation in strongly UV-irradiated gas Authors: A. Veselinova, M. Agúndez, J. R. Goicoechea, M. Menéndez, A. Zanchet, E. Verdasco, P. G. Jambrina, and F. J. Aoiz Ref. A&A 648, A76 (2021) https://doi.org/10.1051/0004-6361/202140428
The Role of Conserved Residues in the DeDDh Motif: the Proton-Transfer Mechanism of HIV-1 RNase H The Role of Conserved Residues in the DeDDH Motif: The Proton-Transfer Mechanism of HIV-1 RNase H Authors: Simon L. Dürr, Olga Bohuszewicz, Dénes Berta, Reynier Suardiaz, Pablo G. Jambrina, Christine Peter, Yihan Shao, and Edina Rosta Ref. ACS catal. 2021, 11, 7915-7927 https://doi.org/10.1021/acscatal.1c01493
DpgC-catalyzed peroxidation of DPA-CoA: insights into the spin-forbidden transition and charge transfer mechanisms DpgC‐Catalyzed Peroxidation of 3,5‐Dihydroxyphenylacetyl‐CoA (DPA‐CoA): Insights into the Spin‐Forbidden Transition and Charge Transfer Mechanisms Authors: Pablo Ortega, Alexandre Zanchet, Cristina Sanz-Sanz, Susana Gómez-Carrasco, Lola González-Sánchez, Pablo G. Jambrina Ref. Chem. Eur. J. 21, 1700-1712 (2021) https://doi.org/10.1002/chem.202002993
Multi and single-reference methods for the analysis of multi-state peroxidation of enolates Multi and single-reference methods for the analysis of multi-state peroxidation of enolates Authors: P. Ortega, S. Gil-Guerrero, A. Veselinova, A. Zanchet, L. González-Sánchez, P. G. Jambrina, and C. Sanz-Sanz Ref. J. Chem. Phys. 154, 144303 (2021) https://aip.scitation.org/doi/10.1063/5.0046906.
Controlling the Spin–Orbit Branching Fraction in Molecular Collisions Controlling the Spin–Orbit Branching Fraction in Molecular Collisions Authors: C. G. Heid, I. P. Bentham, V. Walpole, P. G. Jambrina, F. J. Aoiz, M. Brouard Ref. J. Phys. Chem. Lett. 12, 310-316 (2021) https://pubs.acs.org/doi/abs/10.1021/acs.jpclett.0c02941
Vibrational Quenching of CN− in Collisions with He and Ar Vibrational Quenching of CN– in Collisions with He and Ar Authors: Barry Mant, Ersin Yurtsever, Lola González-Sánchez, Roland Wester, and Franco A. Gianturco Ref. J. Chem. Phys. 154, 084305 (2021) https://doi.org/10.1063/5.0039854
Energy-transfer quantum dynamics of HeH + with He atoms: Rotationally inelastic cross sections and rate coefficients Energy-transfer quantum dynamics of HeH+ with He atoms: Rotationally inelastic cross sections and rate coefficients Authors: F. A. Gianturco,K. Giri,L. González-Sánchez,E. Yurtsever,N. Sathyamurthy, and R. Wester Ref. J. Chem. Phys. 154, 054311 (2021) https://doi.org/10.1063/5.0040018
Dynamics of HeHHe+ Rotational State Changes Induced by Collision with He: A Possible New Path in Early Universe Chemistry Dynamics of HeHHe+ Rotational State Changes Induced by Collision with He: A Possible New Path in Early Universe Chemistry Authors: González-Sánchez, Lola; Yurtsever, Ersin; Wester, Roland; Gianturco, Francesco Ref. The Journal of Physical Chemistry A, under revision (2021)
Collision-driven state-changing efficiency of different buffer gases in cold traps: He(1S), Ar (1S) and p-H2(1Σ) on trapped CN−(1Σ)t Collision-driven state-changing efficiency of different buffer gases in cold traps: He(1S), Ar (1S) and p-H2(1Σ) on trapped CN−(1Σ)t Authors: Lola González-Sánchez, Ersin Yurtsever, Barry P. Mant, Roland Wester and Franco A. Gianturco Ref.Phys. Chem. Chem. Phys., (2021), Advance Article https://doi.org/10.1039/D0CP03440A
Signature of shape resonances on the differential cross sections of the S(1D) + H2 reaction Signature of shape resonances on the differential cross sections of the S(1D) + H2 reaction Authors: P. G. Jambrina, M. Lara, F. J. Aoiz Ref. J. Chem. Phys. 154, 124304 (2021) https://aip.scitation.org/doi/full/10.1063/5.0042967