TRAVIS - Trajectory Analyzer and Visualizer

Downloads

• TRAVIS Source Code (.tar.gz)²
  TRAVIS  (Change date: 29/07/2022) (TRAVIS Changelog on travis-analyzer.de³)
• Precompiled Windows Executable (64 bit, ZIP file, preferred version)⁴
  TRAVIS  (Change date: 29/07/2022) (TRAVIS Changelog on travis-analyzer.de⁵)
• Precompiled Windows Executable (32 bit, ZIP file, compatibility version)⁶
  TRAVIS  (Change date: 29/07/2022) (TRAVIS Changelog on travis-analyzer.de⁵)
• Quick Start Guide (PDF)⁷
• Tutorial: How to calculate infrared and Raman spectra from MD⁸

The source code, a short documentation and further informations are also available on the TRAVIS homepage: www.travis-analyzer.de ⁹

Articles about TRAVIS:

• M. Brehm, B. Kirchner
  TRAVIS - A Free Analyzer and Visualizer for Monte Carlo and Molecular Dynamics Trajectories,
  J. Chem. Inf. Model., (2011), 51, 2007-2023
  DOI: 10.1021/ci200217w ¹⁰
• M. Thomas, M. Brehm, R. Fligg, P. Vöhringer, B. Kirchner
  Computing vibrational spectra from ab initio molecular dynamics
  Phys. Chem. Chem. Phys., (2013), 15, 6608-6622
  DOI: 10.1039/C3CP44302G¹¹
• M. Thomas, M. Brehm, O. Hollóczki, Z. Kelemen, L. Nylászi, T. Pasinszki, B. Kirchner
  Simulating the vibrational spectra of ionic liquid systems: 1-Ethyl-3-methylimidazolium acetate and its mixtures
  J. Chem. Phys. (2014), 141, 024510
  DOI: 10.1063/1.4887082 ¹²
• M. Thomas, M.Brehm, B. Kirchner
  Voronoi dipole moments for the simulation of bulk phase vibrational spectra
  Phys. Chem. Chem. Phys., (2015), 17, 3207-3213
  DOI: 10.1039/C4CP05272B ¹³
• M. Brehm, H. Weber, M. Thomas, O. Hollóczki, B. Kirchner
  Domain Analysis in Nanostructured Liquids: A Post-Molecular Dynamics Study at the Example of Ionic Liquids
  ChemPhysChem, (2015), 16 , 3271-3277
  DOI: 10.1002/cphc.201500471¹⁴
• O. Hollóczki, M. Macchiagodena, H. Weber, M. Thomas, M. Brehm, A. Stark, O. Russina, A. Triolo, B. Kirchner
  Triphilic Ionic-Liquid Mixtures: Fluorinated and Nonfluorinated Aprotic Ionic-Liquid Mixtures
  ChemPhysChem (2015), 16, 3325-3333
  DOI: 10.1002/cphc.201500473 ¹⁵
• M. Thomas, B. Kirchner
  Classical Magnetic Dipole Moments for the Simulation of Vibrational Circular Dichroism by Ab Initio Molecular Dynamics
  J. Phys. Chem. Lett. (2016), 7, 509-513
  DOI: 10.1021/acs.jpclett.5b02752 ¹⁶
• S. Gehrke, M. von Domaros, R. Clark, O. Hollóczki, M. Brehm, T. Welton, A. Luzar, B. Kirchner
  Structure and lifetimes in ionic liquids and their mixtures
  Faraday Discuss. (2018), 206, 219-245.
  DOI: 10.1039/C7FD00166E ¹⁷
• S. Gehrke, R. Macchieraldo, B. Kirchner
  Understanding the fluidity of condensed phase systems in terms of voids – Novel algorithm, implementation and application
  Phys. Chem. Chem. Phys. (2019), 21, 4988-4997.
  DOI: 10.1039/C8CP07120A¹⁸
• M. Brehm, M. Thomas, S. Gehrke, B. Kirchner
  TRAVIS — A free analyzer for trajectories from molecular simulation
  J. Chem. Phys. (2020), 152 164105.
  DOI: 10.1063/5.0005078¹⁹