Logo

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 “Mariani, A.”. Show all citations.

Go to Author List, go to Journal List.

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

13 A. Mariani, L. Engelbrecht, A. L. Donne, F. Mocci, E. Bodo, S. Passerini:
"Disclosing the Hierarchical Structure of Ionic Liquid Mixtures by Multiscale Computational Methods"
Theoretical and Computational Approaches to Predicting Ionic Liquid Properties 2021, 1–67.     (DOI 10.1016/B978-0-12-820280-7.00014-0 ) ⭳ Bib
Uses TRAVIS.
12 N. Karimi, M. Zarrabeitia, A. Mariani, D. Gatti, A. Varzi, S. Passerini:
"Nonfluorinated Ionic Liquid Electrolytes for Lithium Metal Batteries: Ionic Conduction, Electrochemistry, and Interphase Formation"
Adv. Energy Mater. 2021, 11 (4), 2003521.     (DOI 10.1002/aenm.202003521 ) ⭳ Bib
Uses TRAVIS for RDF, SDF.
11 J. Han, A. Mariani, A. Varzi, S. Passerini:
"Green and Low-Cost Acetate-Based Electrolytes for the Highly Reversible Zinc Anode"
J. Power Sources 2021, 485, 229329.     (DOI 10.1016/j.jpowsour.2020.229329 ) ⭳ Bib
Uses TRAVIS for SDF.
10 J. Han, M. Zarrabeitia, A. Mariani, Z. Jusys, M. Hekmatfar, H. Zhang, D. Geiger, U. Kaiser, R. J. Behm, A. Varzi, S. Passerini:
"Halide-Free Water-in-Salt Electrolytes for Stable Aqueous Sodium-Ion Batteries"
Nano Energy 2020, 77, 105176.     (DOI 10.1016/j.nanoen.2020.105176 ) ⭳ Bib
Uses TRAVIS for SDF, CDF.
9 A. Mariani, M. Bonomo, S. Passerini:
"Statistic-Driven Proton Transfer Affecting Nanoscopic Organization in an Ethylammonium Nitrate Ionic Liquid and 1,4-Diaminobutane Binary Mixture: A Steamy Pizza Model"
Symmetry 2019, 11 (11), 1425.     (DOI 10.3390/sym11111425 ) ⭳ Bib
Uses TRAVIS for RDF, NI, SDF, SFac.
8 M. Campetella, A. Mariani, C. Sadun, B. Wu, E. W. Castner, L. Gontrani:
"Structure and Dynamics of Propylammonium Nitrate-Acetonitrile Mixtures: An Intricate Multi-Scale System Probed with Experimental and Theoretical Techniques"
J. Chem. Phys. 2018, 148 (13), 134507.     (DOI 10.1063/1.5021868 ) ⭳ Bib
Uses TRAVIS for RDF, SFac.
7 A. Mariani, M. Campetella, C. Fasolato, M. Daniele, F. Capitani, L. Bencivenni, P. Postorino, S. Lupi, R. Caminiti, L. Gontrani:
"A Joint Experimental and Computational Study on Ethylammonium Nitrate-Ethylene Glycol 1:1 Mixture. Structural, Kinetic, Dynamic and Spectroscopic Properties"
J. Mol. Liq. 2017, 226, 2–8.     (DOI 10.1016/j.molliq.2016.08.043 ) ⭳ Bib
Uses TRAVIS for RDF, NI, SDF, Aggr.
6 A. Mariani, R. Caminiti, F. Ramondo, G. Salvitti, F. Mocci, L. Gontrani:
"Inhomogeneity in Ethylammonium Nitrate–Acetonitrile Binary Mixtures: The Highest “low Q Excess” Reported to Date"
J. Phys. Chem. Lett. 2017, 8 (15), 3512–3522.     (DOI 10.1021/acs.jpclett.7b01244 ) ⭳ Bib
Uses TRAVIS for RDF, SDF.
5 A. Mariani, R. Caminiti, M. Campetella, L. Gontrani:
"Pressure-Induced Mesoscopic Disorder in Protic Ionic Liquids: First Computational Study"
Phys. Chem. Chem. Phys. 2016, 18 (4), 2297–2302.     (DOI 10.1039/C5CP06800B ) ⭳ Bib
Uses TRAVIS for SDF, Domain.
4 A. Mariani, P. Ballirano, F. Angiolari, R. Caminiti, L. Gontrani:
"Does High Pressure Induce Structural Reorganization in Linear Alcohols? A Computational Answer"
ChemPhysChem 2016, 17 (19), 3023–3029.     (DOI 10.1002/cphc.201600268 ) ⭳ Bib
Uses TRAVIS for CDF.
3 O. Russina, M. Macchiagodena, B. Kirchner, A. Mariani, B. Aoun, M. Russina, R. Caminiti, A. Triolo:
"Association in Ethylammonium Nitrate–Dimethyl Sulfoxide Mixtures: First Structural and Dynamical Evidences"
J. Non-Cryst. Solids 2015, 407, 333–338.     (DOI 10.1016/j.jnoncrysol.2014.08.051 ) ⭳ Bib
Uses TRAVIS for RDF, CDF, SFac.
2 O. Russina, A. Mariani, R. Caminiti, A. Triolo:
"Structure of a Binary Mixture of Ethylammonium Nitrate and Methanol"
J. Solution Chem. 2015, 44 (3-4), 669–685.     (DOI 10.1007/s10953-015-0311-7 ) ⭳ Bib
Uses TRAVIS for RDF, CDF.
1 A. Mariani, O. Russina, R. Caminiti, A. Triolo:
"Structural Organization in a Methanol:Ethylammonium Nitrate (1:4) Mixture: A Joint X-Ray/Neutron Diffraction and Computational Study"
J. Mol. Liq. 2015, 212, 947–956.     (DOI 10.1016/j.molliq.2015.10.054 ) ⭳ Bib
Uses TRAVIS for RDF, SDF, CDF, SFac.

— Author List —

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

Go to Article List, go to Journal List.

40 different authors contributed to the 13 articles shown above.

Citations ↓ A–ZAuthor Name ↓ A–Z
13(show)Mariani, A.
7(show)Caminiti, R.
5(show)Gontrani, L.
5(show)Passerini, S.
3(show)Campetella, M.
3(show)Russina, O.
3(show)Triolo, A.
3(show)Varzi, A.
2(show)Han, J.
2(show)Mocci, F.
2(show)Zarrabeitia, M.
1(show)Angiolari, F.
1(show)Aoun, B.
1(show)Ballirano, P.
1(show)Behm, R. J.
1(show)Bencivenni, L.
1(show)Bodo, E.
1(show)Bonomo, M.
1(show)Capitani, F.
1(show)Castner, E. W.
1(show)Daniele, M.
1(show)Donne, A. L.
1(show)Engelbrecht, L.
1(show)Fasolato, C.
1(show)Gatti, D.
1(show)Geiger, D.
1(show)Hekmatfar, M.
1(show)Jusys, Z.
1(show)Kaiser, U.
1(show)Karimi, N.
1(show)Kirchner, B.
1(show)Lupi, S.
1(show)Macchiagodena, M.
1(show)Postorino, P.
1(show)Ramondo, F.
1(show)Russina, M.
1(show)Sadun, C.
1(show)Salvitti, G.
1(show)Wu, B.
1(show)Zhang, H.

— Journal List —

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

Go to Article List, go to Author List.

The 13 articles shown above were published in 12 different journals.

CitationsJournal Name
2(show)J. Mol. Liq.
1(show)Adv. Energy Mater.
1(show)ChemPhysChem
1(show)J. Chem. Phys.
1(show)J. Non-Cryst. Solids
1(show)J. Phys. Chem. Lett.
1(show)J. Power Sources
1(show)J. Solution Chem.
1(show)Nano Energy
1(show)Phys. Chem. Chem. Phys.
1(show)Symmetry
1(show)Theoretical and Computational Approaches to Predicting Ionic Liquid Properties