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Structure: Internal structure identifier : 1085139
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Combining Machine Learning Approaches and Accurate Ab Initio Enhanced Sampling Methods for Prebiotic Chemical Reactions in Solution

Timothée Devergne , Théo Magrino , Fabio Pietrucci , A. Marco Saitta
Journal of Chemical Theory and Computation, 2022, 18 (9), pp.5410-5421. ⟨10.1021/acs.jctc.2c00400⟩
Journal articles hal-03927894v1

Disorder-order phase transition at high pressure in ammonium fluoride

Christophe Bellin , Adrien Mafety , Chandrabhas Narayana , Paola Giura , Gwenaelle Rousse et al.
Physical Review B, 2017, 96 (9), pp.094110. ⟨10.1103/PhysRevB.96.094110⟩
Journal articles hal-04009674v1

Extraordinarily Stable Noncubic Structures of Au: A High-Pressure and -Temperature Study

Gangaiah Mettela , Yesudhas Sorb , Abhay Shukla , Christophe Bellin , Volodymyr Svitlyk et al.
Chemistry of Materials, 2017, 29 (4), pp.1485-1489. ⟨10.1021/acs.chemmater.6b03418⟩
Journal articles hal-04009697v1
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Atomic distribution and local structure in ice VII from in situ neutron diffraction

Keishiro Yamashita , Kazuki Komatsu , Stefan Klotz , Oscar Fabelo , Maria T Fernández-Díaz et al.
Proceedings of the National Academy of Sciences of the United States of America, 2022, 119 (40), pp.e2208717119. ⟨10.1073/pnas.2208717119⟩
Journal articles hal-03879209v1

Scaling and Confinement in Ultrathin Chalcogenide Films as Exemplified by GeTe

Peter Kerres , Yiming Zhou , Hetal Vaishnav , Mohit Raghuwanshi , Jiangjing Wang et al.
Small, 2022, 18 (21), pp.2201753. ⟨10.1002/smll.202201753⟩
Journal articles hal-04009623v1
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Chiral Helices Formation by Self-Assembled Molecules on Semiconductor Flexible Substrates

Hong Po , Corentin Dabard , Benoît Roman , Etienne Reyssat , Benoit Baptiste et al.
ACS Nano, 2022, pp.acsnano.1c09982. ⟨10.1021/acsnano.1c09982⟩
Journal articles hal-03553850v1
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Likelihood-based non-Markovian models from molecular dynamics

Hadrien Vroylandt , Ludovic Goudenège , Pierre Monmarché , Fabio Pietrucci , Benjamin Rotenberg et al.
Proceedings of the National Academy of Sciences of the United States of America, 2022, 119 (13), ⟨10.1073/pnas.2117586119⟩
Journal articles hal-03621742v1
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The Vanishing Confinement Regime in THz HgTe Nanocrystals Studied Under Extreme Conditions of Temperature and Pressure

Stefano Pierini , Francesco Capitani , Michael Scimeca , Sergei Kozlov , Debora Pierucci et al.
Journal of Physical Chemistry Letters, 2022, pp.6919-6926. ⟨10.1021/acs.jpclett.2c01636⟩
Journal articles hal-03737454v1

Electron localization and possible phase separation in the absence of a charge density wave in single-phase 1T-VS$_2$

Andrea Gauzzi , A. Sellam , G. Rousse , Yannick Klein , D. Taverna et al.
Journal of Physics: Condensed Matter, 2014, 31 (31), pp.31LT01. ⟨10.1088/1361-648X/ab1d9b⟩
Journal articles hal-04043035v1