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Potential energy surface of interaction of two diatomic molecules for air flows simulation at intermediate temperatures

  • Published:2020-08 Issue: Volume:536 Page:110850
  • ISSN:0301-0104
  • Container-title:Chemical Physics
  • language:en
  • Short-container-title:Chemical Physics

Author:

Yakunchikov Artem,Kosyanchuk Vasily,Kroupnov Alexander,Pogosbekian Michael,Bryukhanov Ilya,Iuldasheva Aliya

Funder

Russian Foundation for Basic Research

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Reference48 articles.

1. A combined Event-Driven/Time-Driven molecular dynamics algorithm for the simulation of shock waves in rarefied gases;Valentini;J. Comput. Phys.,2009

2. Event-driven molecular dynamics in parallel;Miller;J. Comput. Phys.,2004

3. DynamO: A free O(N) general event-driven molecular-dynamics simulator;Bannerman;J. Comput. Chem.,2011

4. Application of event-driven molecular dynamics approach to rarefied gas dynamics problems;Yakunchikov;Comput. Fluids,2018

5. Ab initio simulation of transport phenomena in rarefied gases;Sharipov;Phys. Rev. E,2012

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