437 citations
- University of CyprusCY163 papers
- Deutsches Elektronen-Synchrotron DESYDE82 papers
- John von Neumann Institute for ComputingDE66 papers
- University of BonnDE66 papers
- Humboldt-Universität zu BerlinDE44 papers
- Temple UniversityUS41 papers
- University of WuppertalDE38 papers
- Massachusetts Institute of TechnologyUS34 papers
- University of Rome Tor VergataIT25 papers
- Centre National de la Recherche ScientifiqueFR19 papers
- University of BernCH19 papers
- Adam Mickiewicz University in PoznańPL18 papers
Showing 2016 · physics.chem-phShow all
3 papers · 2 filters
physics.chem-ph2016★ 40 cited
An experimental and theoretical investigation of the C(1D) + D2 reaction
Kevin M. Hickson, Yury V. Suleimanov
In a previous joint experimental and theoretical study of the barrierless chemical reaction C(1D) + H2 at low temperatures (300-50 K) [K. M. Hickson, J.-C. Loison, H. Guo, Y. V. Su…
physics.chem-ph2016★ 23 cited
Thermal Rate Coefficients for the Astrochemical Process C + CH C + H by Ring Polymer Molecular Dynamics
Sergio Rampino, Yury V. Suleimanov
Thermal rate coefficients for the astrochemical reaction C + CH C + H were computed in the temperature range 20-300 K by using novel rate theory based on ring polym…
physics.chem-ph2016★ 152 cited
Chemical Reaction Rates from Ring Polymer Molecular Dynamics: Theory and Practical Applications
Yury V. Suleimanov, F. Javier Aoiz, Hua Guo
This Feature Article presents an overview of the current status of Ring Polymer Molecular Dynamics (RPMD) rate theory. We first analyze the RPMD approach and its connection to quan…