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DpgC‐Catalyzed Peroxidation of 3,5‐Dihydroxyphenylacetyl‐CoA (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

by mario | May 20, 2021 | 2021

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....
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

by mario | Apr 19, 2021 | 2021

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)...
Controlling the Spin–Orbit Branching Fraction in Molecular Collisions

Controlling the Spin–Orbit Branching Fraction in Molecular Collisions

by mario | Apr 19, 2021 | 2021

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)...
Vibrational Quenching of CN− in Collisions with He and Ar

Vibrational Quenching of CN− in Collisions with He and Ar

by mario | Apr 19, 2021 | 2021

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)...
Vibrational Quenching of CN− in Collisions with He and Ar

Energy-transfer quantum dynamics of HeH + with He atoms: Rotationally inelastic cross sections and rate coefficients

by mario | Apr 19, 2021 | 2021

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)...
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Recent Posts

  • DpgC‐Catalyzed Peroxidation of 3,5‐Dihydroxyphenylacetyl‐CoA (DPA‐CoA): Insights into the Spin‐Forbidden Transition and Charge Transfer Mechanisms
  • Multi and single-reference methods for the analysis of multi-state peroxidation of enolates
  • Controlling the Spin–Orbit Branching Fraction in Molecular Collisions
  • Vibrational Quenching of CN− in Collisions with He and Ar
  • Energy-transfer quantum dynamics of HeH + with He atoms: Rotationally inelastic cross sections and rate coefficients

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