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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.

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 457 such publications, written by 1009 different authors.
433 out of these (94.75 %) actually used TRAVIS for results in the manuscript.

Only showing work with “3D CDFs” from TRAVIS. Show all citations.

Go to Author List, go to Journal List.

3 citations match the query.  Show continuous list view.

— 2018 —

3 M. Macchiagodena, G. Mancini, M. Pagliai, G. Cardini, V. Barone:
"New Atomistic Model of Pyrrole with Improved Liquid State Properties and Structure"
Int. J. Quantum Chem. 2018, 118 (9), e25554.     (DOI 10.1002/qua.25554 ) ⭳ Bib
Uses TRAVIS for RDF, CDF,
3D CDF
, SFac, Aggr.

— 2013 —

2 M. Brehm, H. Weber, A. S. Pensado, A. Stark, B. Kirchner:
"Liquid Structure and Cluster Formation in Ionic Liquid/Water Mixtures – An Extensive ab initio Molecular Dynamics Study on 1-Ethyl-3-methylimidazolium Acetate/Water Mixtures – Part 2"
Z. Phys. Chem. 2013, 227 (2-3), 177–204.     (DOI 10.1524/zpch.2012.0327 ) ⭳ Bib
Uses TRAVIS for RDF, SDF, CDF,
3D CDF
.

— 2012 —

1 M. Brüssel, M. Brehm, A. S. Pensado, F. Malberg, M. Ramzan, A. Stark, B. Kirchner:
"On the Ideality of Binary Mixtures of Ionic Liquids"
Phys. Chem. Chem. Phys. 2012, 14 (38), 13204.     (DOI 10.1039/c2cp41926b ) ⭳ Bib
Uses TRAVIS for RDF, NI, CDF,
3D CDF
, MSD, Power.


— Author List —

Go to Article List, go to Journal List.

13 different authors contributed to the 3 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
2(show)Brehm, M.
2(show)Kirchner, B.
2(show)Pensado, A. S.
2(show)Stark, A.
1(show)Barone, V.
1(show)Brüssel, M.
1(show)Cardini, G.
1(show)Macchiagodena, M.
1(show)Malberg, F.
1(show)Mancini, G.
1(show)Pagliai, M.
1(show)Ramzan, M.
1(show)Weber, H.

— Journal List —

Go to Article List, go to Author List.

The 3 articles shown above were published in 3 different journals.

CitationsJournal Name
1(show)Int. J. Quantum Chem.
1(show)Phys. Chem. Chem. Phys.
1(show)Z. Phys. Chem.

Quick Links:

TRAVIS ORCA MD Spectroscopy bqb Format