Zobrazeno 1 - 10
of 84
pro vyhledávání: '"Todorov, Ilian T."'
Publikováno v:
Scientific Reports 13, 15664 (2023)
Fluidity, the ability of liquids to flow, is the key property distinguishing liquids from solids. This fluidity is set by the mobile transit atoms moving from one quasi-equilibrium point to the next. The nature of this transit motion is unknown. Here
Externí odkaz:
http://arxiv.org/abs/2304.11909
Soft condensed matter structures often challenge us with complex many-body phenomena governed by collective modes spanning wide spatial and temporal domains. In order to successfully tackle such problems mesoscopic coarse-grained (CG) statistical mod
Externí odkaz:
http://arxiv.org/abs/2301.00465
Software citation contributes to achieving software sustainability in two ways: It provides an impact metric to incentivize stakeholders to make software sustainable. It also provides references to software used in research, which can be reused and a
Externí odkaz:
http://arxiv.org/abs/2103.06681
Autor:
Horsch, Martin Thomas, Chiacchiera, Silvia, Schembera, Björn, Seaton, Michael A., Todorov, Ilian T.
The European Materials and Modelling Ontology (EMMO) has recently been advanced in the computational molecular engineering and multiscale modelling communities as a top-level ontology, aiming to support semantic interoperability and data integration
Externí odkaz:
http://arxiv.org/abs/2003.11370
Autor:
Horsch, Martin Thomas, Chiacchiera, Silvia, Seaton, Michael A., Todorov, Ilian T., Šindelka, Karel, Lísal, Martin, Andreon, Barbara, Kaiser, Esteban Bayro, Mogni, Gabriele, Goldbeck, Gerhard, Kunze, Ralf, Summer, Georg, Fiseni, Andreas, Brüning, Hauke, Schiffels, Peter, Cavalcanti, Welchy Leite
The Virtual Materials Marketplace (VIMMP) project, which develops an open platform for providing and accessing services related to materials modelling, is presented with a focus on its ontology development and data technology aspects. Within VIMMP, a
Externí odkaz:
http://arxiv.org/abs/1912.01519
Autor:
Crossley-Lewis, Joe, Dunn, Josh, Buda, Corneliu, Sunley, Glenn J., Elena, Alin M., Todorov, Ilian T., Yong, Chin W., Glowacki, David R., Mulholland, Adrian J., Allan, Neil L.
Publikováno v:
In Journal of Molecular Graphics and Modelling December 2023 125
Autor:
Barron, Vivian Walter, Yong, Chin W., Slowey, Alex, Todorov, Ilian T., Roberts, Kevin J., Hammond, Robert B.
Publikováno v:
In Journal of Molecular Liquids 1 August 2023 383
Autor:
Sokhan, Vlad P, Todorov, Ilian T
We present a novel approach of mapping dissipative particle dynamics (DPD) into classical molecular dynamics. By introducing the invariant volume element representing the swarm of atoms we show that the interactions between the emerging Brownian quas
Externí odkaz:
http://arxiv.org/abs/1805.07151
Autor:
Zarkadoula, Eva, Duffy, Dorothy M., Nordlund, Kai, Seaton, Michael A., Todorov, Ilian T., Weber, William J., Trachenko, Kostya
Although the effects of the electronic excitations during high-energy radiation damage processes are not currently understood, it is shown that their role in the interaction of radiation with matter is important. We perform molecular dynamics simulat
Externí odkaz:
http://arxiv.org/abs/1411.7674