Thomas Spura - Publications

Affiliations: 
2013-2015 Chemistry University of Paderborn 

9/14 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Kapil V, Rossi M, Marsalek O, Petraglia R, Litman Y, Spura T, Cheng B, Cuzzocrea A, Meißner RH, Wilkins DM, Helfrecht BA, Juda P, Bienvenue SP, Fang W, Kessler J, et al. i-PI 2.0: A universal force engine for advanced molecular simulations Computer Physics Communications. 236: 214-223. DOI: 10.1016/J.Cpc.2018.09.020  0.551
2016 Köster A, Spura T, Rutkai G, Kessler J, Wiebeler H, Vrabec J, Kühne TD. Assessing the accuracy of improved force-matched water models derived from Ab initio molecular dynamics simulations. Journal of Computational Chemistry. PMID 27232117 DOI: 10.1002/Jcc.24398  0.692
2016 John C, Spura T, Habershon S, Kühne TD. Quantum ring-polymer contraction method: Including nuclear quantum effects at no additional computational cost in comparison to ab initio molecular dynamics. Physical Review. E. 93: 043305. PMID 27176426 DOI: 10.1103/Physreve.93.043305  0.635
2015 Kessler J, Elgabarty H, Spura T, Karhan K, Partovi-Azar P, Hassanali AA, Kühne TD. Structure and Dynamics of the Instantaneous Water/Vapor Interface Revisited by Path-Integral and Ab Initio Molecular Dynamics Simulations. The Journal of Physical Chemistry. B. 119: 10079-86. PMID 26174102 DOI: 10.1021/Acs.Jpcb.5B04185  0.48
2015 Spura T, Elgabarty H, Kühne TD. Correction: "On-the-fly" coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer. Physical Chemistry Chemical Physics : Pccp. 17: 19673-4. PMID 26151943 DOI: 10.1039/C5Cp90118A  0.754
2015 Spura T, Elgabarty H, Kühne TD. "On-the-fly" coupled cluster path-integral molecular dynamics: impact of nuclear quantum effects on the protonated water dimer. Physical Chemistry Chemical Physics : Pccp. 17: 14355-9. PMID 25650366 DOI: 10.1039/c4cp05192k  0.758
2015 Spura T, John C, Habershon S, Kühne TD. Nuclear quantum effects in liquid water from path-integral simulations using an ab initio force-matching approach Molecular Physics. 113: 808-822. DOI: 10.1080/00268976.2014.981231  0.727
2013 Dömer M, Spura T, Khaliullin RZ, Kühne TD. Tetrahedral if liquid | Tetraedrisch, wenn flüssig Nachrichten Aus Der Chemie. 61: 1203-1206. DOI: 10.1515/nachrchem.2013.61.12.1203  0.644
2013 Dömer M, Spura T, Khaliullin RZ, Kühne TD. Tetraedrisch, wenn flüssig Nachrichten Aus Der Chemie. 61: 1203-1206. DOI: 10.1002/Nadc.201390399  0.628
Low-probability matches (unlikely to be authored by this person)
1986 Spura TM. An introduction to flight simulation for the aerodynamic engineer Sae Technical Papers. DOI: 10.4271/861815  0.138
2005 Spura TM, Accettullo EE, Franke J, Zaychik V. Operator interfaces for organic command and control of unmanned vehicles Annual Forum Proceedings - Ahs International. 2: 798-808.  0.095
2006 Chun WH, Spura T, Alvidrez FC, Stiles RJ. 14. Spatial Dialog and Unmanned Aerial Vehicles Advances in Human Performance and Cognitive Engineering Research. 7: 193-206. DOI: 10.1016/S1479-3601(05)07014-1  0.051
2005 Franke JL, Zaychik V, Spura TM, Alves EE. Inverting the operator/vehicle ratio: Approaches to next generation UAV command and control Auvsi's Unmanned Systems North America 2005 - Proceedings. 555-565.  0.051
2004 Spura TM, Franke JL, Szczerba RJ, Scarangella M. Command and control of unmanned vehicles - Where are we going? Annual Forum Proceedings - American Helicopter Society. 1: 848-860.  0.038
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