Search results
- 1.0507166 - ÚCHP 2020 RIV US eng C - Conference Paper (international conference)
Barnes, B.C. - Spear, C.E. - Leiter, K.W. - Becker, R. - Knap, J. - Lísal, Martin - Brennan, J.K.
Hierarchical Multiscale Framework for Materials Modeling: Equation of State Implementation and Application to a Taylor Anvil Impact Test of RDX.
AIP Conference Proceedings. Vol. 1793. MELVILLE: AIP Publishing, 2017, č. článku 080001. ISBN 978-0-7354-1457-0. ISSN 0094-243X.
[Biennial American-Physical-Society (APS) Conference on Shock Compression of Condensed Matter (SCCM) /19./. Tampa (US), 14.06.2015-19.06.2015]
Institutional support: RVO:67985858
Keywords : scale modeling * multi-physics simulation * taylor anvil impact test
OECD category: Physical chemistry
Permanent Link: http://hdl.handle.net/11104/0298208File Download Size Commentary Version Access SKMBT_C22019080112590.pdf 0 1.8 MB Publisher’s postprint open-access - 2.0507165 - ÚCHP 2020 RIV US eng C - Conference Paper (international conference)
Sellers, M.S. - Lísal, Martin - Schweigert, I. - Larentzos, J.P. - Brennan, J.K.
Shock Simulations of a Single-Site Coarse-Grain RDX Model using the Dissipative Particle Dynamics Method with Reactivity.
AIP Conference Proceedings. Vol. 1793. MELVILLE: AIP Publishing, 2017, č. článku 040008. ISBN 978-0-7354-1457-0. ISSN 0094-243X.
[Biennial American-Physical-Society (APS) Conference on Shock Compression of Condensed Matter (SCCM) /19./. Tampa (US), 14.06.2015-19.06.2015]
R&D Projects: GA ČR(CZ) GA13-02938S
Grant - others:ARL(US) W911NF-10-2-003; ONR BAA(US) 12-001
Institutional support: RVO:67985858
Keywords : DPD-RX method * description * decomposition mechanism
OECD category: Physical chemistry
Permanent Link: http://hdl.handle.net/11104/0298207File Download Size Commentary Version Access SKMBT_C22019080112430.pdf 0 2.4 MB Publisher’s postprint open-access - 3.0486114 - ÚCHP 2018 US eng C - Conference Paper (international conference)
Moore, J.D. - Larentzos, J.P. - Izvekov, S. - Lísal, Martin - Brennan, J.K.
Comprehensive Suite of Coarse-grain Modeling Tools Formulated upon Dissipative Particle Dynamics.
Abstracts of Papers of the ACS, Volume 246. Washington: American Chemical Society, 2013, č. článku 151-PHYS. ISBN N. ISSN 0065-7727.
[National Meeting of the American-Chemical-Society (ACS) /2496./. Indianapolis, Indiana (US), 08.09.2013-12.09.2013]
Institutional support: RVO:67985858
Keywords : dissipative particle dynamics * modeling tools
OECD category: Physical chemistry
Permanent Link: http://hdl.handle.net/11104/0280987 - 4.0485820 - ÚCHP 2018 US eng C - Conference Paper (international conference)
Lísal, Martin
Molecular Dynamics Simulations of the Liquid Surface of Imidazolium-based [Tf2N-] Ionic Liquids.
Abstracts of Papers of the ACS, Volume 242. Washington: American Chemical Society, 2011, č. článku 264-COLL. ISBN N. ISSN 0065-7727.
[National Meeting of the American-Chemical-Society (ACS) /242./. Denver, CO (US), 28.08.2011-01.09.2011]
Institutional support: RVO:67985858
Keywords : molecular dynamics simulation * ionic liquids
OECD category: Physical chemistry
Permanent Link: http://hdl.handle.net/11104/0280760 - 5.0460518 - ÚCHP 2017 PT eng C - Conference Paper (international conference)
Michalec, Lukáš - Lísal, Martin
Organic Matter of Shale: Insight from Atomistic Simulations.
Book of Abstracts. Porto: Facultade de Engenharia da Universidade do Porto, 2016 - (Macedo, M.), II - P53. ISBN 978-989-20-6695-0.
[International Conference on Properties and Phase Equilibria for Product and Process Design /14./. Porto (PT), 22.05.2016-26.05.2016]
R&D Projects: GA ČR(CZ) GA13-02938S
EU Projects: European Commission(XE) 640979 - ShaleXenvironmenT
Institutional support: RVO:67985858
Keywords : all-atom molecular dynamics * asphaltene * kerogen
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0260574File Download Size Commentary Version Access SKMBT_22316060112413.pdf 1 440.2 KB Publisher’s postprint open-access - 6.0394571 - ÚCHP 2014 US eng C - Conference Paper (international conference)
Kárászová, Magda - Šimčík, Miroslav - Friess, K. - Lísal, Martin - Jansen, J. C. - Sedláková, Zuzana - Růžička, Marek - Izák, Pavel
Comparison of Theoretical and Experimental Mass Transfer Coefficients of Gases in Supported Ionic Liquid Membranes.
Abstract Book. Prague: -, 2013, s. 1. ISBN N.
[Annual Meeting NAMS 2013 /23/. Boise, Idaho (US), 08.06.2013-12.06.2013]
R&D Projects: GA ČR GAP106/10/1194
Institutional support: RVO:67985858
Keywords : mass transfer coefficients * ionic liquid membranes * permeability and selectivity
Subject RIV: CI - Industrial Chemistry, Chemical Engineering
Permanent Link: http://hdl.handle.net/11104/0222804File Download Size Commentary Version Access SKMBT_C22013080813021.pdf 1 518.6 KB Publisher’s postprint open-access - 7.0381493 - ÚCHP 2013 DE eng C - Conference Paper (international conference)
Lísal, Martin - Chvál, Z. - Storch, Jan - Izák, Pavel - Aim, Karel
Molecular Dynamics Simulations Study on Chiral Room -Temperature Ionic Liquids.
Poster Programme. Frankfurt: DECHEMA, 2012, P2-35. ISBN N.
[European Symposium on Applied Thermodynamics - ESAT 2012 /26./. Potsdam (DE), 07.10.2012-10.10.2012]
Institutional support: RVO:67985858
Keywords : ionic liquids * molecular dynamics simulations * thermodynamics properties
Subject RIV: CF - Physical ; Theoretical Chemistry
http://events.dechema.de/events/en/esat2012.html
Permanent Link: http://hdl.handle.net/11104/0211951File Download Size Commentary Version Access SKMBT_C22012101214122.pdf 1 385.1 KB Other open-access - 8.0376173 - ÚCHP 2013 RIV US eng C - Conference Paper (international conference)
Moore, J.D. - Izvekov, S. - Lísal, Martin - Brennan, J.K.
Particle Based Multiscale Modeling of the Dynamic Response of RDX.
AIP Conference Proceedings. New York: American Institute of Physics, 2011 - (Elert, M.; Buttler, W.; Borg, J.; Jordan, J.; Vogler, T.), s. 1327-1240. ISBN 978-0-7354-1006-0. ISSN 0094-243X.
[Conference of the APS Topical Group on Shock Compression of Condensed Matter. Chicago, Illinois (US), 26.06.2011-01.07.2011]
Grant - others:ARL(US) W911NF-10-2-0039; ARL(US) ID201003211
Institutional research plan: CEZ:AV0Z40720504
Keywords : dissipative particle dynamics * rdx * mesoscale modeling
Subject RIV: CF - Physical ; Theoretical Chemistry
http://scitation.aip.org/getpdf/servlet/GetPDFServlet?filetype=pdf&id=APCPCS001426000001001237000001&idtype=cvips&doi=10.1063/1.3686504&prog=normal&bypassSSO=1
Permanent Link: http://hdl.handle.net/11104/0208649File Download Size Commentary Version Access 20120403214930.pdf 0 305.1 KB Publisher’s postprint open-access - 9.0371108 - ÚCHP 2012 CZ eng C - Conference Paper (international conference)
Posel, Z. - Lísal, Martin - Rousseau, B.
Scalling Laws for Polymer in Dissipative Particle Dynamics Revised.
Posters. -: -, 2010, s. 54. ISBN N.
[Liblice Conference on the Statistical Mechanics of Liquids /8./. Brno (CZ), 13.06.2010-18.06.2010]
Institutional research plan: CEZ:AV0Z40720504
Keywords : scalling laws * polymers
Subject RIV: CF - Physical ; Theoretical Chemistry
Permanent Link: http://hdl.handle.net/11104/0204725 - 10.0366993 - ÚCHP 2012 CZ eng C - Conference Paper (international conference)
Posel, Z. - Lísal, Martin
Scaling Laws for Polymers in Dissipative Particle Dynamics Revised.
Sborník. Praha: Česká společnost chemického inženýrství, 2011 - (Halfar, R.), s. 180. ISBN 978-80-905035-0-2.
[Konference chemického a procesního inženýrství CHISA 2011 /58./. Srní, Šumava (CZ), 24.10.2011-27.10.2011]
Institutional research plan: CEZ:AV0Z40720504
Keywords : Rouse theory * dynamic behavior for PE * spring potential
Subject RIV: CF - Physical ; Theoretical Chemistry
www.chisa.cz/2011
Permanent Link: http://hdl.handle.net/11104/0201797