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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 articles
hal-03927894v1
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Disorder-order phase transition at high pressure in ammonium fluoride
Christophe Bellin
,
Adrien Mafety
,
Chandrabhas Narayana
,
Paola Giura
,
Gwenaelle Rousse
et al.
Journal articles
hal-04009674v1
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Extraordinarily Stable Noncubic Structures of Au: A High-Pressure and -Temperature Study
Gangaiah Mettela
,
Yesudhas Sorb
,
Abhay Shukla
,
Christophe Bellin
,
Volodymyr Svitlyk
et al.
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
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Scaling and Confinement in Ultrathin Chalcogenide Films as Exemplified by GeTe
Peter Kerres
,
Yiming Zhou
,
Hetal Vaishnav
,
Mohit Raghuwanshi
,
Jiangjing Wang
et al.
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.
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.
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 articles
hal-03737454v1
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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 articles
hal-04043035v1
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