Neighbors Map: An efficient atomic descriptor for structural analysis von Allera, Arnaud, Goryaeva, Alexandra M., Lafourcade, Paul, Maillet, Jean-Bernard, Marinica, Mihai-Cosmin

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A molecular dynamics investigation of laminar pyrocarbons elasticity up to high-temperatures von Polewczyk, Franck, Lafourcade, Paul, Pineau, Nicolas, Denoual, Christophe, Vignoles, Gérard L., Leyssale, Jean-Marc

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Dislocation storage-release-recovery model for metals under strain rates from 10−3 to 107 s−1, and application to tantalum von Denoual, Christophe, Pellegrini, Yves-Patrick, Lafourcade, Paul, Madec, Ronan

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Irreversible Deformation Mechanisms for 1,3,5-Triamino-2,4,6-Trinitrobenzene Single Crystal through Molecular Dynamics Simulations von Lafourcade, Paul, Denoual, Christophe, Maillet, Jean-Bernard

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Extraction of slip systems and twinning variants from a Lagrangian analysis of molecular dynamics simulations von Lafourcade, Paul, Ewald, Guillaume, Carrard, Thierry, Denoual, Christophe

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Temperature-dependent elasticity of single crystalline graphite von Polewczyk, Franck, Leyssale, Jean-Marc, Lafourcade, Paul

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Elastic instability in graphite single crystal under dynamic triaxial compression: Effect of strain-rate on the resulting microstructure von Lafourcade, Paul, Denoual, Christophe, Maillet, Jean-Bernard

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On-the-fly clustering for exascale molecular dynamics simulations von Babilotte, Killian, Dubois, Alizée, Carrard, Thierry, Lafourcade, Paul, Videau, Laurent, Molinari, Jean-François, Soulard, Laurent

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Dislocation Core Structure at Finite Temperature Inferred by Molecular Dynamics Simulations for 1,3,5-Triamino-2,4,6-trinitrobenzene Single Crystal von Lafourcade, Paul, Denoual, Christophe, Maillet, Jean-Bernard

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New Nonreactive Force Field for Accurate Molecular Dynamics Simulations of TATB at Extreme Conditions von Kroonblawd, Matthew P., Lafourcade, Paul, Fried, Laurence E., Maillet, Jean-Bernard, Sewell, Tommy

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Multiscale Reactive Model for 1,3,5-Triamino-2,4,6-trinitrobenzene Inferred by Reactive MD Simulations and Unsupervised Learning von Lafourcade, P., Maillet, J.-B., Roche, J., Sakano, M., Hamilton, B. W., Strachan, A.

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Polygranular image guided atomistic reconstruction: A parametric model of pyrocarbon nanostructure von Polewczyk, Franck, Lafourcade, Paul, Costa, Jean-Pierre Da, Vignoles, Gérard, Leyssale, Jean-Marc

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Elasticity of dense anisotropic carbons: A machine learning model of the structure–property relationship informed by large scale molecular dynamics data von Polewczyk, Franck, Leyssale, Jean-Marc, Aurel, Philippe, Pineau, Nicolas, Denoual, Christophe, Vignoles, Gerard L., Lafourcade, Paul

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The critical layer in quadratic flow boundary layers over acoustic linings von King, Matthew J., Brambley, Edward J., Liupekevicius, Renan, Radia, Miren, Lafourcade, Paul, Shah, Tauqeer H.

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Elastic Anisotropy of 1,3,5‐Triamino‐2,4,6‐Trinitrobenzene as a Function of Temperature and Pressure: A Molecular Dynamics Study von Lafourcade, Paul, Maillet, Jean‐Bernard, Bruzy, Nicolas, Denoual, Christophe

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Detection of plasticity mechanisms in molecular dynamics: Application to TATB single crystal von Lafourcade, Paul, Denoual, Christophe, Maillet, Jean-Bernard

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Mesoscopic constitutive law with nonlinear elasticity and phase transformation for the twinning-buckling of TATB under dynamic loading von Lafourcade, Paul, Denoual, Christophe, Maillet, Jean-Bernard

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Robust crystal structure identification at extreme conditions using a density-independent spectral descriptor and supervised learning von Lafourcade, Paul, Maillet, Jean-Bernard, Denoual, Christophe, Duval, Eléonore, Allera, Arnaud, Goryaeva, Alexandra M., Marinica, Mihai-Cosmin

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Modélisation Multiéchelle du Comportement Mécanique d'un Matériau Energétique : Le TATB von Lafourcade, Paul

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ExaNBody: A HPC Framework for N-Body Applications von Carrard, Thierry, Prat, Raphaël, Latu, Guillaume, Babilotte, Killian, Lafourcade, Paul, Amarsid, Lhassan, Soulard, Laurent

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