Andres Jaramillo-Botero

Summary

Affiliation: California Institute of Technology
Country: USA

Publications

  1. doi request reprint Large-scale, long-term nonadiabatic electron molecular dynamics for describing material properties and phenomena in extreme environments
    Andres Jaramillo-Botero
    Chemistry and Chemical Engineering, California Institute of Technology, 1200 E California Blvd, Pasadena, California 91125, USA
    J Comput Chem 32:497-512. 2011
  2. ncbi request reprint Hypervelocity impact effect of molecules from Enceladus' plume and Titan's upper atmosphere on NASA's Cassini spectrometer from reactive dynamics simulation
    Andres Jaramillo-Botero
    Materials and Process Simulation Center, California Institute of Technology, 1200 E California Boulevard, Pasadena, California 91125, USA
    Phys Rev Lett 109:213201. 2012
  3. doi request reprint First-principles-based multiscale, multiparadigm molecular mechanics and dynamics methods for describing complex chemical processes
    Andres Jaramillo-Botero
    Chemistry and Chemical Engineering, California Institute of Technology, Mail Code 139 74, 1200 E California Blvd, Pasadena, CA 91125, USA
    Top Curr Chem 307:1-42. 2012
  4. ncbi request reprint Nonadiabatic study of dynamic electronic effects during brittle fracture of silicon
    Patrick L Theofanis
    Division of Chemistry and Chemical Engineering, California Institute of Technology, 1200 East California Boulevard, Pasadena, California 91125, USA
    Phys Rev Lett 108:045501. 2012

Collaborators

Detail Information

Publications4

  1. doi request reprint Large-scale, long-term nonadiabatic electron molecular dynamics for describing material properties and phenomena in extreme environments
    Andres Jaramillo-Botero
    Chemistry and Chemical Engineering, California Institute of Technology, 1200 E California Blvd, Pasadena, California 91125, USA
    J Comput Chem 32:497-512. 2011
    ..As an absolute reference, an NVT run with 2 million particle lithium bulk system (0.5 M nuclei and 1.5 M electrons) on Lobo takes ∼0.44 s/timestep on 1024 processors (∼1 day/ps using an integration timestep of 0.005 fs)...
  2. ncbi request reprint Hypervelocity impact effect of molecules from Enceladus' plume and Titan's upper atmosphere on NASA's Cassini spectrometer from reactive dynamics simulation
    Andres Jaramillo-Botero
    Materials and Process Simulation Center, California Institute of Technology, 1200 E California Boulevard, Pasadena, California 91125, USA
    Phys Rev Lett 109:213201. 2012
    ..g., Enceladus). This may be valuable in steering modifications in future missions...
  3. doi request reprint First-principles-based multiscale, multiparadigm molecular mechanics and dynamics methods for describing complex chemical processes
    Andres Jaramillo-Botero
    Chemistry and Chemical Engineering, California Institute of Technology, Mail Code 139 74, 1200 E California Blvd, Pasadena, CA 91125, USA
    Top Curr Chem 307:1-42. 2012
    ....
  4. ncbi request reprint Nonadiabatic study of dynamic electronic effects during brittle fracture of silicon
    Patrick L Theofanis
    Division of Chemistry and Chemical Engineering, California Institute of Technology, 1200 East California Boulevard, Pasadena, California 91125, USA
    Phys Rev Lett 108:045501. 2012
    ..We find that strain-induced surface rearrangements and local heating cause ionization of electrons at the fracture surfaces...