TRAVIS – Trajectory Analyzer and Visualizer


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 —

Only showing results in journal “Chem. Phys. Lett.”. Show all citations.

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6 citations match the query.  Show continuous list view.

— 2019 —

6 B. Dutta, J. Chowdhury:
"Existence of Dimeric Hydroxylamine-O-Sulfonic Acid: Experimental Observations Aided by ab initio, DFT, Car-Parrinello and Born – Oppenheimer on the Fly Dynamics"
Chem. Phys. Lett. 2019, 732, 136645.     (DOI 10.1016/j.cplett.2019.136645 ) ⭳ Bib
Uses TRAVIS for Spec.

— 2018 —

5 F. Sessa, P. D'Angelo, V. Migliorati:
"Combined Distribution Functions: A Powerful Tool to Identify Cation Coordination Geometries in Liquid Systems"
Chem. Phys. Lett. 2018, 691, 437–443.     (DOI 10.1016/j.cplett.2017.11.056 ) ⭳ Bib
4 B. Milovanović, M. Petković, M. Etinski:
"Raman Spectra of Aqueous Uracil Stacked Dimer: First Principle Molecular Dynamics Simulation"
Chem. Phys. Lett. 2018, 713, 15–20.     (DOI 10.1016/j.cplett.2018.10.015 ) ⭳ Bib
Uses TRAVIS for Spec.

— 2017 —

3 M. Macchiagodena, G. Mancini, M. Pagliai, G. D. Frate, V. Barone:
"Fine-Tuning of Atomic Point Charges: Classical Simulations of Pyridine in Different Environments"
Chem. Phys. Lett. 2017, 677, 120–126.     (DOI 10.1016/j.cplett.2017.04.004 ) ⭳ Bib
2 L. Gontrani, R. Caminiti, U. Salma, M. Campetella:
"A Structural and Theoretical Study of the Alkylammonium Nitrates Forefather: Liquid Methylammonium Nitrate"
Chem. Phys. Lett. 2017, 684, 304–309.     (DOI 10.1016/j.cplett.2017.07.017 ) ⭳ Bib
Uses TRAVIS for Aggr.
1 L. Gontrani, F. Leonelli, M. Campetella:
"An X-Ray and Computational Study of Liquid Pentylammonium Nitrate"
Chem. Phys. Lett. 2017, 687, 38–43.     (DOI 10.1016/j.cplett.2017.08.068 ) ⭳ Bib
Uses TRAVIS for Aggr.

— Author List —

Only showing results in journal “Chem. Phys. Lett.”. Show all citations.

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18 different authors contributed to the 6 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
2(show)Campetella, M.
2(show)Gontrani, L.
1(show)Barone, V.
1(show)Caminiti, R.
1(show)Chowdhury, J.
1(show)Dutta, B.
1(show)D'Angelo, P.
1(show)Etinski, M.
1(show)Frate, G. D.
1(show)Leonelli, F.
1(show)Macchiagodena, M.
1(show)Mancini, G.
1(show)Milovanović, B.
1(show)Migliorati, V.
1(show)Pagliai, M.
1(show)Petković, M.
1(show)Salma, U.
1(show)Sessa, F.

— Journal List —

Only showing results in journal “Chem. Phys. Lett.”. Show all citations.

Go to Article List, go to Author List.

The 6 articles shown above were published in 1 different journals.

CitationsJournal Name
6(show)Chem. Phys. Lett.