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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 —

Only showing results by author “Ribeiro, M. C. C.”. Show all citations.

Go to Author List, go to Journal List.

10 citations match the query.  Show sub-lists per year.

10 K. Bernardino, Y. Zhang, M. C. C. Ribeiro, E. J. Maginn:
"Effect of Alkyl-Group Flexibility on the Melting Point of Imidazolium-Based Ionic Liquids"
J. Chem. Phys. 2020, 153 (4), 44504.     (DOI 10.1063/5.0015992 ) ⭳ Bib
Uses TRAVIS for RDF.
9 K. Bernardino, K. Goloviznina, M. C. Gomes, A. A. H. Pádua, M. C. C. Ribeiro:
"Ion Pair Free Energy Surface as a Probe of Ionic Liquid Structure"
J. Chem. Phys. 2020, 152 (1), 14103.     (DOI 10.1063/1.5128693 ) ⭳ Bib
Uses TRAVIS for RDF, SDF.
8 K. Bernardino, T. A. Lima, M. C. C. Ribeiro:
"Low-Temperature Phase Transitions of the Ionic Liquid 1-Ethyl-3-methylimidazolium Dicyanamide"
J. Phys. Chem. B 2019, 123 (44), 9418–9427.     (DOI 10.1021/acs.jpcb.9b07654 ) ⭳ Bib
Uses TRAVIS for SDF, Aggr.
7 J. Kiefer, K. Noack, T. C. Penna, M. C. C. Ribeiro, H. Weber, B. Kirchner:
"Vibrational Signatures of Anionic Cyano Groups in Imidazolium Ionic Liquids"
Vib. Spectrosc. 2017, 91, 141–146.     (DOI 10.1016/j.vibspec.2016.05.004 ) ⭳ Bib
Uses TRAVIS for Power, Spec.
6 V. H. Paschoal, L. F. O. Faria, M. C. C. Ribeiro:
"Vibrational Spectroscopy of Ionic Liquids"
Chem. Rev. 2017, 117 (10), 7053–7112.     (DOI 10.1021/acs.chemrev.6b00461 ) ⭳ Bib
5 L. F. O. Faria, V. H. Paschoal, T. A. Lima, F. F. Ferreira, R. S. Freitas, M. C. C. Ribeiro:
"Local Order–Disorder Transition Driving by Structural Heterogeneity in a Benzyl Functionalized Ionic Liquid"
J. Phys. Chem. B 2017, 121 (42), 9902–9909.     (DOI 10.1021/acs.jpcb.7b08829 ) ⭳ Bib
Uses TRAVIS for SDF.
4 T. A. Lima, V. H. Paschoal, L. F. O. Faria, M. C. C. Ribeiro, C. Giles:
"Comparing Two Tetraalkylammonium Ionic Liquids. I. Liquid Phase Structure"
J. Chem. Phys. 2016, 144 (22), 224504.     (DOI 10.1063/1.4953414 ) ⭳ Bib
Uses TRAVIS for RDF, SDF, CDF.
3 K. B. Dhungana, L. F. O. Faria, B. Wu, M. Liang, M. C. C. Ribeiro, C. J. Margulis, E. W. Castner:
"Structure of Cyano-Anion Ionic Liquids: X-Ray Scattering and Simulations"
J. Chem. Phys. 2016, 145 (2), 24503.     (DOI 10.1063/1.4955186 ) ⭳ Bib
Uses TRAVIS for SDF.
2 V. L. Martins, N. Sanchez-Ramirez, M. C. C. Ribeiro, R. M. Torresi:
"Two Phosphonium Ionic Liquids with High Li+ Transport Number"
Phys. Chem. Chem. Phys. 2015, 17 (35), 23041–23051.     (DOI 10.1039/C5CP02799C ) ⭳ Bib
Uses TRAVIS for RDF, SDF, CDF.
1 N. Sanchez-Ramirez, V. L. Martins, R. A. Ando, F. F. Camilo, S. M. Urahata, M. C. C. Ribeiro, R. M. Torresi:
"Physicochemical Properties of Three Ionic Liquids Containing a Tetracyanoborate Anion and Their Lithium Salt Mixtures"
J. Phys. Chem. B 2014, 118 (29), 8772–8781.     (DOI 10.1021/jp505051v ) ⭳ Bib
Uses TRAVIS for SDF, CDF.

— Author List —

Only showing results by author “Ribeiro, M. C. C.”. Show all citations.

Go to Article List, go to Journal List.

29 different authors contributed to the 10 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
10(show)Ribeiro, M. C. C.
4(show)Faria, L. F. O.
3(show)Bernardino, K.
3(show)Lima, T. A.
3(show)Paschoal, V. H.
2(show)Martins, V. L.
2(show)Sanchez-Ramirez, N.
2(show)Torresi, R. M.
1(show)Ando, R. A.
1(show)Camilo, F. F.
1(show)Castner, E. W.
1(show)Dhungana, K. B.
1(show)Ferreira, F. F.
1(show)Freitas, R. S.
1(show)Goloviznina, K.
1(show)Gomes, M. C.
1(show)Giles, C.
1(show)Kiefer, J.
1(show)Kirchner, B.
1(show)Liang, M.
1(show)Maginn, E. J.
1(show)Margulis, C. J.
1(show)Noack, K.
1(show)Pádua, A. A. H.
1(show)Penna, T. C.
1(show)Urahata, S. M.
1(show)Weber, H.
1(show)Wu, B.
1(show)Zhang, Y.

— Journal List —

Only showing results by author “Ribeiro, M. C. C.”. Show all citations.

Go to Article List, go to Author List.

The 10 articles shown above were published in 5 different journals.

CitationsJournal Name
4(show)J. Chem. Phys.
3(show)J. Phys. Chem. B
1(show)Chem. Rev.
1(show)Phys. Chem. Chem. Phys.
1(show)Vib. Spectrosc.