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authIdHal_s : carlo-pierleoni

Coupled electron-ion Monte Carlo simulation of hydrogen molecular crystals

Giovanni Rillo , Miguel Morales , David M. Ceperley , Carlo Pierleoni
Journal of Chemical Physics, 2018, 148 (10), ⟨10.1063/1.5001387⟩
Journal articles hal-01802732v1

Multiscale Coarse Graining of Diblock Copolymer Self-Assembly: From Monomers to Ordered Micelles

Carlo Pierleoni , Chris Addison , Jean-Pierre Hansen , Vincent Krakoviack
Physical Review Letters, 2006, 96 (12), ⟨10.1103/PhysRevLett.96.128302⟩
Journal articles hal-01897103v1
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Electronic band gaps from Quantum Monte Carlo methods

Yubo Yang , Vitaly Gorelov , Carlo Pierleoni , David M. Ceperley , Markus Holzmann et al.
Physical Review B, 2020, 101, pp.085115. ⟨10.1103/PhysRevB.101.085115⟩
Journal articles hal-02994393v1

Electronic band gaps from Quantum Monte Carlo methods

Yubo Yang , Vitaly Gorelov , Carlo Pierleoni , David M. Ceperley , Markus Holzmann et al.
2019
Preprints, Working Papers, ... hal-02324356v1

The momentum distribution of the homogeneous electron gas

Markus Holzmann , Bernard Bernu , Carlo Pierleoni , Jeremy Mcminis , David M. Ceperley et al.
Physical Review Letters, 2011, 107 (11), pp.110402. ⟨10.1103/PhysRevLett.107.110402⟩
Journal articles hal-00960152v1

Liquid–liquid phase transition in hydrogen by coupled electron–ion Monte Carlo simulations

Carlo Pierleoni , Miguel Morales , Giovanni Rillo , Markus Holzmann , David M. Ceperley et al.
Proceedings of the National Academy of Sciences of the United States of America, 2016, 113 (18), pp.4953 - 4957. ⟨10.1073/pnas.1603853113⟩
Journal articles hal-01802746v1

Characterization of molecular-atomic transformation in fluid hydrogen under pressure via long-wavelength asymptote of charge density fluctuations

Taras M. Bryk , Carlo Pierleoni , Giancarlo Ruocco , Ari Paavo Seitsonen
Journal of Molecular Liquids, 2020, 312, ⟨10.1016/j.molliq.2020.113274⟩
Journal articles hal-02844077v1
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Electronic structure and optical properties of quantum crystals from first principles calculations in the Born-Oppenheimer approximation

Markus Holzmann , Vitaly Gorelov , David M. Ceperley , Carlo Pierleoni
Journal of Chemical Physics, 2020, ⟨10.1063/5.0031843⟩
Journal articles hal-03370275v1

A Review of Equation-of-State Models for Inertial Confinement Fusion Materials

A. Gaffney , S. Hu , P. Arnault , A. Becker , L. Benedict et al.
High Energy Density Physics, 2018, ⟨10.1016/j.hedp.2018.08.001⟩
Journal articles hal-01867704v1

Filament flexibility enhances power transduction of F-actin bundles

Alessia Perilli , Carlo Pierleoni , Jean-Paul Ryckaert
2018
Preprints, Working Papers, ... hal-01867736v1

Local structure in dense hydrogen at the liquid-liquid phase transition by coupled electron-ion Monte Carlo

Carlo Pierleoni , Markus Holzmann , David M. Ceperley
Contributions to Plasma Physics, 2018, 58 (2-3), pp.99 - 106. ⟨10.1002/ctpp.201700184⟩
Journal articles hal-01802729v1

Entropic self-assembly of diblock copolymers into disordered and ordered micellar phases

Barbara Capone , Carlo Pierleoni , Jean-Pierre Hansen , Vincent Krakoviack
Journal of Physical Chemistry B, 2009, 113, pp.3629. ⟨10.1021/jp805946z⟩
Journal articles hal-01113627v1

Electronic structure and optical properties of quantum crystals from first principles calculations in the Born-Oppenheimer approximation

Markus Holzmann , Vitaly Gorelov , David M. Ceperley , Carlo Pierleoni
2020
Preprints, Working Papers, ... hal-02994348v1

Electronic energy gap closure and metal-insulator transition in dense liquid hydrogen

Markus Holzmann , Vitaly Gorelov , David M. Ceperley , Carlo Pierleoni
2020
Preprints, Working Papers, ... hal-02994355v1
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Multi-scale simulation of the adsorption of lithium ion on graphite surface

Michele Ruggeri , Kyle Reeves , Tzu-Yao Hsu , Guillaume Jeanmairet , Mathieu Salanne et al.
Journal of Chemical Physics, 2022, 156 (9), pp.094709. ⟨10.1063/5.0082944⟩
Journal articles hal-03607697v1

Coupled Electron Ion Monte Carlo Calculations of Dense Metallic Hydrogen

Carlo Pierleoni , David M. Ceperley , Markus Holzmann
Physical Review Letters, 2004, 95, pp.146402
Journal articles hal-00107326v1
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Coupled Electron Ion Monte Carlo Calculations of Atomic Hydrogen

Markus Holzmann , Carlo Pierleoni , David M. Ceperley
2004
Preprints, Working Papers, ... hal-00003115v1

Quantum Monte Carlo determination of the principal Hugoniot of deuterium

Markus Holzmann , Michele Ruggeri , David M. Ceperley , Carlo Pierleoni , David Ceperley et al.
Physical Review B, 2020, 102 (14), ⟨10.1103/PhysRevB.102.144108⟩
Journal articles hal-02994356v1

On the force–velocity relationship of a bundle of rigid bio-filaments

Alessia Perilli , Carlo Pierleoni , Giovanni Ciccotti , Jean-Paul Ryckaert
Journal of Chemical Physics, 2018, 148 (9), ⟨10.1063/1.5001124⟩
Journal articles hal-01802736v1

Theory of finite size effects for electronic quantum Monte Carlo calculations of liquids and solids

Markus Holzmann , Raymond Clay , Miguel Morales , Norm Tubman , David M. Ceperley et al.
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2016, 94 (3), ⟨10.1103/PhysRevB.94.035126⟩
Journal articles hal-01802743v1

Electron localization properties in high pressure hydrogen at the liquid-liquid phase transition by Coupled Electron-Ion Monte Carlo

Carlo Pierleoni , Giovanni Rillo , David M. Ceperley , Markus Holzmann
2018
Preprints, Working Papers, ... hal-01867724v1
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Crystal Stability of Diblock Copolymer Micelles in Solution

John Jairo Molina , Carlo Pierleoni , Barbara Capone , Jean-Pierre Hansen , Igor Oliveira et al.
Molecular Physics, 2009, 107 (04-06), pp.535-548. ⟨10.1080/00268970902877779⟩
Journal articles hal-00513281v1

Energy Gap Closure of Crystalline Molecular Hydrogen with Pressure

Markus Holzmann , Vitaly Gorelov , David M. Ceperley , Carlo Pierleoni , David Ceperley et al.
Physical Review Letters, 2020, 124 (11), ⟨10.1103/PhysRevLett.124.116401⟩
Journal articles hal-02994379v1
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Electronic energy gap closure and metal-insulator transition in dense liquid hydrogen

Vitaly Gorelov , David M. Ceperley , Markus Holzmann , Carlo Pierleoni
Physical Review B, 2020, 102 (19), ⟨10.1103/PhysRevB.102.195133⟩
Journal articles hal-03370279v1