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TRAVIS – Trajectory Analyzer and Visualizer

TRAVIS

TRAVIS, which stands for Trajectory Analyzer and Visualizer, is a software tool which can compute a plethora of functions and histograms from molecular dynamics and Monte Carlo simulation trajectories. I am the main developer of the TRAVIS program package.

Please visit the TRAVIS website:  www.travis-analyzer.de

In April 2020, our new open access article on TRAVIS has been published. It describes many of the new features and algorithms which have been added to TRAVIS within the last nine years. Please have a look:

M. Brehm, M. Thomas, S. Gehrke, B. Kirchner:
“TRAVIS – A Free Analyzer for Trajectories from Molecular Simulation”,
J. Chem. Phys. 2020, 152 (16), 164105, DOI 10.1063/5.0005078.

Please see also our new tutorial on computing vibrational spectra with CP2k and TRAVIS (Oct 2018).


— Work Citing TRAVIS —

This is a list of publications which cite the original TRAVIS article from 2011. Currently, there are 539 such publications, written by 1201 different authors.
512 out of these (94.99 %) actually used TRAVIS for results in the manuscript.

Only showing results by author “Chandra, A.”. Show all citations.

Go to Author List, go to Journal List.

4 citations match the query.  Show continuous list view.

— 2020 —

4 S. Yadav, A. Chandra:
"Solvation Shell of the Nitrite Ion in Water: An ab initio Molecular Dynamics Study"
J. Phys. Chem. B 2020, 124 (33), 7194–7204.     (DOI 10.1021/acs.jpcb.0c02221 ) ⭳ Bib
Uses TRAVIS for SDF.

— 2019 —

3 D. Ojha, A. Chandra:
"Urea in Water: Structure, Dynamics, and Vibrational Echo Spectroscopy from First-Principles Simulations"
J. Phys. Chem. B 2019, 123 (15), 3325–3336.     (DOI 10.1021/acs.jpcb.9b01904 ) ⭳ Bib
Uses TRAVIS for SDF.

— 2018 —

2 S. Yadav, A. Chandra:
"Structural and Dynamical Nature of Hydration Shells of the Carbonate Ion in Water: An ab initio Molecular Dynamics Study"
J. Phys. Chem. B 2018, 122 (4), 1495–1504.     (DOI 10.1021/acs.jpcb.7b11636 ) ⭳ Bib
Uses TRAVIS for SDF.

— 2017 —

1 S. Yadav, A. Choudhary, A. Chandra:
"A First-Principles Molecular Dynamics Study of the Solvation Shell Structure, Vibrational Spectra, Polarity, and Dynamics around a Nitrate Ion in Aqueous Solution"
J. Phys. Chem. B 2017, 121 (38), 9032–9044.     (DOI 10.1021/acs.jpcb.7b06809 ) ⭳ Bib
Uses TRAVIS for SDF.


— Author List —

Go to Article List, go to Journal List.

4 different authors contributed to the 4 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
4(show)Chandra, A.
3(show)Yadav, S.
1(show)Choudhary, A.
1(show)Ojha, D.

— Journal List —

Go to Article List, go to Author List.

The 4 articles shown above were published in 1 different journals.

CitationsJournal Name
4(show)J. Phys. Chem. B