TRAVIS – Trajectory Analyzer and Visualizer
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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: Please see also our new tutorial on computing vibrational spectra with CP2k and TRAVIS (Oct 2018). |
Want to join the TRAVIS team? There are two PhD positions available in the group of Prof. Martin Brehm at the University of Paderborn (Germany). Please see the official announcements in German and English language. You can apply until 15.03.2024.
— Work Citing TRAVIS —
Only showing work with “Structure Factors / van Howe Correlations” from TRAVIS. Show all citations.
Go to Author List, go to Journal List.
Show only articles where TRAVIS was used to compute...
... any result (766)
... RDFs (g(r), Radial Distribution Functions) (358)
... Number Integrals / Coordination Numbers (110)
... SDFs (Spatial Distribution Functions) (374)
... CDFs (Combined Distribution Functions) (210)
... 3D CDFs (3)
... Structure Factors / van Howe Correlations (59)
... Density Profiles (30)
... Aggregate Lifetimes (H Bonds, ...), Reactive Flux (86)
... MSDs (Mean Square Displacements), Diffusion Coefficients (78)
... Vector Reorientation Dynamics / Rotational Relaxation Times (17)
... Voronoi Statistics / Surface Coverage / Visualization (20)
... Voronoi-based Domain Analysis (39)
... Power Spectra / Vibrational Density of States (67)
... Vibrational Spectra (IR, Raman, VCD, ROA) (79)
... Bulk Phase Normal Modes (8)
... Order Parameters (3)
... Sankey Diagrams / Hydrogen Bond Topology (8)
... Connection Matrix (8)
59 citations match the query. Show continuous list view.
— 2023 —
— 2022 —
— 2021 —
— 2020 —
— 2019 —
| 21 | K. G. Vishnu, A. Strachan: "Investigation of Structural Ordering in Network Forming Ionic Liquids: A Molecular Dynamics Study" J. Chem. Phys. 2019, 150 (14), 144904. (DOI 10.1063/1.5082186 ) ⭳ Bib Uses TRAVIS for SDF, SFac . |
| 20 | 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 . |
| 19 | T. Aashish, B. S. Mallik: "Rattling Transport of Lithium Ion in the Cavities of Model Solid Electrolyte Interphase" J. Phys. Chem. C 2019, 123 (41), 25015–25024. (DOI 10.1021/acs.jpcc.9b04160 ) ⭳ Bib Uses TRAVIS for SDF, SFac . |
— 2018 —
— 2017 —
| 12 | S. I. Lall-Ramnarine, M. Zhao, C. Rodriguez, R. Fernandez, N. Zmich, E. D. Fernandez, S. B. Dhiman, E. W. Castner, J. F. Wishart: "Connecting Structural and Transport Properties of Ionic Liquids with Cationic Oligoether Chains" J. Electrochem. Soc. 2017, 164 (8), H5247–H5262. (DOI 10.1149/2.0371708jes ) ⭳ Bib Uses TRAVIS for RDF, SDF, SFac . |
| 11 | M. Campetella, M. Montagna, L. Gontrani, E. Scarpellini, E. Bodo: "Unexpected Proton Mobility in the Bulk Phase of Cholinium-Based Ionic Liquids: New Insights from Theoretical Calculations" Phys. Chem. Chem. Phys. 2017, 19 (19), 11869–11880. (DOI 10.1039/C7CP01050H ) ⭳ Bib Uses TRAVIS for RDF, SFac . |
— 2016 —
| 10 | F. Lo Celso, B. Aoun, A. Triolo, O. Russina: "Liquid Structure of Dibutyl Sulfoxide" Phys. Chem. Chem. Phys. 2016, 18 (23), 15980–15987. (DOI 10.1039/C6CP02335E ) ⭳ Bib Uses TRAVIS for RDF, SDF, CDF, SFac , MSD, RDyn. |
| 9 | M. Campetella, E. Bodo, M. Montagna, S. D. Santis, L. Gontrani: "Theoretical Study of Ionic Liquids Based on the Cholinium Cation. Ab initio Simulations of their Condensed Phases" J. Chem. Phys. 2016, 144 (10), 104504. (DOI 10.1063/1.4943197 ) ⭳ Bib Uses TRAVIS for RDF, SFac . |
— 2015 —
— 2014 —
| 2 | E. Bodo, S. Mangialardo, F. Capitani, L. Gontrani, F. Leonelli, P. Postorino: "Interaction of a Long Alkyl Chain Protic Ionic Liquid and Water" J. Chem. Phys. 2014, 140 (20), 204503. (DOI 10.1063/1.4876036 ) ⭳ Bib Uses TRAVIS for RDF, SFac . |
— 2013 —
| 1 | M. Campetella, L. Gontrani, E. Bodo, F. Ceccacci, F. C. Marincola, R. Caminiti: "Conformational Isomerisms and Nano-Aggregation in Substituted Alkylammonium Nitrates Ionic Liquids: An X-Ray and Computational Study of 2-Methoxyethylammonium Nitrate" J. Chem. Phys. 2013, 138 (18), 184506. (DOI 10.1063/1.4803799 ) ⭳ Bib Uses TRAVIS for RDF, NI, SFac . |
— Author List —
Only showing work with “Structure Factors / van Howe Correlations” from TRAVIS. Show all citations.
Go to Article List, go to Journal List.
199 different authors contributed to the 59 articles shown above.
| Citations ↓ A–Z | Author Name ↓ A–Z | |
|---|---|---|
| 1 | (show) | Aashish, T. |
| 1 | (show) | Ahmadi, R. |
| 1 | (show) | Alavianmehr, M. M. |
| 1 | (show) | Alcalde, R. |
| 1 | (show) | Anchieta, C. G. |
| 2 | (show) | Aoun, B. |
| 2 | (show) | Aparicio, S. |
| 2 | (show) | Aquilanti, G. |
| 1 | (show) | Atilhan, M. |
| 1 | (show) | Avila, J. |
| 1 | (show) | Bakis, E. |
| 1 | (show) | Barone, V. |
| 1 | (show) | Barros, L. M. S. |
| 1 | (show) | Bassu, G. |
| 1 | (show) | Benassi, P. |
| 1 | (show) | Benito, C. |
| 2 | (show) | Berthin, R. |
| 1 | (show) | Besnard, M. |
| 3 | (show) | Bhargava, B. L. |
| 1 | (show) | Behm, R. J. |
| 4 | (show) | Bodo, E. |
| 1 | (show) | Bonomo, M. |
| 3 | (show) | Brehm, M. |
| 1 | (show) | Burian, A. |
| 1 | (show) | Busato, M. |
| 1 | (show) | Cabaço, M. I. |
| 3 | (show) | Caminiti, R. |
| 4 | (show) | Campetella, M. |
| 1 | (show) | Capitani, F. |
| 1 | (show) | Cardini, G. |
| 2 | (show) | Castner, E. W. |
| 1 | (show) | Ceccacci, F. |
| 1 | (show) | Chaban, V. V. |
| 1 | (show) | Chater, P. |
| 1 | (show) | Colella, A. |
| 1 | (show) | Coutinho, J. A. P. |
| 1 | (show) | Cruz, C. |
| 1 | (show) | Dadmun, M. |
| 1 | (show) | Danten, Y. |
| 1 | (show) | Dasari, S. |
| 2 | (show) | de Freitas, A. A. |
| 1 | (show) | de Souza, R. M. |
| 1 | (show) | Demir, B. |
| 1 | (show) | Dias, L. G. |
| 1 | (show) | Dhiman, S. B. |
| 1 | (show) | Doherty, B. W. |
| 1 | (show) | Doubek, G. |
| 1 | (show) | Dumée, L. F. |
| 3 | (show) | D'Angelo, P. |
| 1 | (show) | Fontaine, O. |
| 1 | (show) | Fraenza, C. C. |
| 1 | (show) | Fratini, E. |
| 1 | (show) | Gärtner, S. |
| 3 | (show) | Goloviznina, K. |
| 2 | (show) | Gomes, M. C. |
| 1 | (show) | Gomes, M. F. C. |
| 2 | (show) | Gong, Z. |
| 7 | (show) | Gontrani, L. |
| 1 | (show) | Grelska, J. |
| 1 | (show) | Grimme, S. |
| 1 | (show) | Gurkan, B. |
| 1 | (show) | Gutiérrez, A. |
| 1 | (show) | Hammond, O. S. |
| 2 | (show) | Han, J. |
| 1 | (show) | Hansen, A. |
| 1 | (show) | Hollóczki, O. |
| 1 | (show) | Hosseini, S. M. |
| 1 | (show) | Hunt, P. A. |
| 1 | (show) | Idrissi, A. |
| 1 | (show) | Ferella, F. |
| 1 | (show) | Fernandez, E. D. |
| 1 | (show) | Fernandez, R. |
| 1 | (show) | Filho, R. M. |
| 1 | (show) | Filipe, E. J. M. |
| 1 | (show) | Giudice, A. D. |
| 1 | (show) | Heroux, L. |
| 1 | (show) | Gehrke, S. |
| 1 | (show) | Heid, E. |
| 1 | (show) | Jafta, C. J. |
| 1 | (show) | Jedlovszky, P. |
| 1 | (show) | Juhasz, A. |
| 1 | (show) | Júlio, J. P. O. |
| 1 | (show) | Jurkiewicz, K. |
| 1 | (show) | Jusys, Z. |
| 1 | (show) | Kalugin, O. N. |
| 1 | (show) | Kapoor, U. |
| 1 | (show) | Karttunen, M. |
| 1 | (show) | Kay, C. W. M. |
| 1 | (show) | Kenar, J. A. |
| 4 | (show) | Kirchner, B. |
| 1 | (show) | Keeble, D. S. |
| 1 | (show) | Koverga, V. A. |
| 1 | (show) | Kowsari, M. H. |
| 1 | (show) | Kuenzel, M. |
| 1 | (show) | Lall-Ramnarine, S. I. |
| 3 | (show) | Leonelli, F. |
| 2 | (show) | Lisio, V. D. |
| 8 | (show) | Lo Celso, F. |
| 1 | (show) | Lombardo, R. |
| 1 | (show) | Long, Z. |
| 2 | (show) | Lopes, J. N. C. |
| 1 | (show) | Lourenço, T. C. |
| 4 | (show) | Macchiagodena, M. |
| 1 | (show) | Maity, N. |
| 2 | (show) | Maginn, E. J. |
| 1 | (show) | Malberg, F. |
| 2 | (show) | Mallik, B. S. |
| 2 | (show) | Mancini, G. |
| 1 | (show) | Mangialardo, S. |
| 6 | (show) | Mariani, A. |
| 1 | (show) | Marincola, F. C. |
| 1 | (show) | Marques, H. |
| 1 | (show) | Martinelli, A. |
| 1 | (show) | Mathon, O. |
| 1 | (show) | Mazzilli, V. |
| 1 | (show) | McDaniel, J. |
| 1 | (show) | Melchior, A. |
| 1 | (show) | Mele, A. |
| 1 | (show) | Miannay, F.-A. |
| 3 | (show) | Migliorati, V. |
| 2 | (show) | Montagna, M. |
| 2 | (show) | Moosavi, M. |
| 1 | (show) | Morgado, P. |
| 1 | (show) | Mullaliu, A. |
| 2 | (show) | Muzio, S. D. |
| 1 | (show) | Nardone, M. |
| 1 | (show) | Nepel, T. C. M. |
| 1 | (show) | Olivi, L. |
| 1 | (show) | Ottaviani, C. |
| 2 | (show) | Padua, A. |
| 3 | (show) | Pádua, A. A. H. |
| 2 | (show) | Pagliai, M. |
| 1 | (show) | Palumbo, O. |
| 3 | (show) | Panda, D. K. |
| 1 | (show) | Paolone, A. |
| 2 | (show) | Pascarelli, S. |
| 1 | (show) | Paschoal, V. H. |
| 3 | (show) | Passerini, S. |
| 1 | (show) | Pawlus, S. |
| 1 | (show) | Perlt, E. |
| 1 | (show) | Persson, I. |
| 2 | (show) | Philippi, F. |
| 1 | (show) | Pietro, M. E. D. |
| 1 | (show) | Plechkova, N. V. |
| 1 | (show) | Poe, D. |
| 1 | (show) | Polok, K. |
| 1 | (show) | Postorino, P. |
| 1 | (show) | Procacci, P. |
| 1 | (show) | Pugh, D. |
| 2 | (show) | Ramondo, F. |
| 1 | (show) | Rauber, D. |
| 1 | (show) | Ray, P. |
| 2 | (show) | Ribeiro, M. C. C. |
| 1 | (show) | Reeves, K. G. |
| 1 | (show) | Rodriguez, C. |
| 1 | (show) | Russina, M. |
| 12 | (show) | Russina, O. |
| 1 | (show) | Sadun, C. |
| 1 | (show) | Saielli, G. |
| 2 | (show) | Salanne, M. |
| 1 | (show) | Santis, S. D. |
| 1 | (show) | Scaglione, N. |
| 1 | (show) | Scarpellini, E. |
| 1 | (show) | Schröder, C. |
| 4 | (show) | Serva, A. |
| 1 | (show) | Shah, J. K. |
| 1 | (show) | Silva, G. M. C. |
| 1 | (show) | Silva, J. L. F. D. |
| 1 | (show) | Simon, G. |
| 2 | (show) | Shimizu, K. |
| 1 | (show) | Squire, H. |
| 1 | (show) | Stark, A. |
| 1 | (show) | Steinrücken, E. |
| 1 | (show) | Strachan, A. |
| 1 | (show) | Suarez, S. |
| 1 | (show) | Świątek, A. |
| 1 | (show) | Takamuku, T. |
| 1 | (show) | Thomas, M. |
| 1 | (show) | Torabi, S. M. |
| 2 | (show) | Torkzadeh, M. |
| 1 | (show) | Tow, G. M. |
| 11 | (show) | Triolo, A. |
| 1 | (show) | Tuckerman, M. E. |
| 2 | (show) | Varzi, A. |
| 1 | (show) | Veclani, D. |
| 1 | (show) | Vettori, I. |
| 1 | (show) | Vishnu, K. G. |
| 1 | (show) | Vogel, M. |
| 1 | (show) | Wang, Y. |
| 1 | (show) | Watanabe, M. |
| 1 | (show) | Weber, H. |
| 1 | (show) | Welton, T. |
| 1 | (show) | Wishart, J. F. |
| 1 | (show) | Wu, B. |
| 1 | (show) | Yoshida, Y. |
| 2 | (show) | Zarrabeitia, M. |
| 1 | (show) | Zhang, Y. |
| 1 | (show) | Zhao, M. |
| 1 | (show) | Zmich, N. |
— Journal List —
Only showing work with “Structure Factors / van Howe Correlations” from TRAVIS. Show all citations.
Go to Article List, go to Author List.
The 59 articles shown above were published in 24 different journals.
| Citations | Journal Name | |
|---|---|---|
| 13 | (show) | J. Mol. Liq. |
| 9 | (show) | J. Chem. Phys. |
| 9 | (show) | J. Phys. Chem. B |
| 7 | (show) | Phys. Chem. Chem. Phys. |
| 2 | (show) | Molecules |
| 1 | (show) | Adv. Mater. |
| 1 | (show) | C. R. Chim. |
| 1 | (show) | ChemPhysChem |
| 1 | (show) | Chem Sci |
| 1 | (show) | Ind. Eng. Chem. Res. |
| 1 | (show) | Inorg. Chem. |
| 1 | (show) | Int. J. Quantum Chem. |
| 1 | (show) | J. Chem. Inf. Model. |
| 1 | (show) | J. Chem. Theory Comput. |
| 1 | (show) | J. Electrochem. Soc. |
| 1 | (show) | J. Mater. Chem.A |
| 1 | (show) | J. Mol. Graph. Model. |
| 1 | (show) | J. Non-Cryst. Solids |
| 1 | (show) | J. Phys. Chem. A |
| 1 | (show) | J. Phys. Chem. C |
| 1 | (show) | J. Phys. Chem. Lett. |
| 1 | (show) | Macromolecules |
| 1 | (show) | Small |
| 1 | (show) | Symmetry |
