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authFullName_s : David M. Ceperley

Quantum Monte Carlo Compton profiles of solid and liquid lithium

Markus Holzmann , Yubo Yang , Nozomu Hiraoka , Kazuhiro Matsuda , David M. Ceperley et al.
Physical Review B, 2020, 101 (16), ⟨10.1103/PhysRevB.101.165125⟩
Journal articles hal-02994369v1

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
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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

QMCPACK : an open source ab initio quantum Monte Carlo package for the electronic structure of atoms, molecules and solids

Jeongnim Kim , Andrew Baczewski , Todd D. Beaudet , Anouar Benali , M. Chandler Bennett et al.
Journal of Physics: Condensed Matter, 2018, 30 (19), ⟨10.1088/1361-648X/aab9c3⟩
Journal articles hal-01886251v1

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

Critical Temperature of Bose-Einstein condensation of hard sphere gases

Franck Laloë , David M. Ceperley , Peter Grüter
Physical Review Letters, 1997, 79, pp.3549
Journal articles hal-00001410v1

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

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
Image document

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

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

Momentum Distribution and Renormalization Factor in Sodium and the Electron Gas

Simo Huotari , J. Aleksi Soininen , Tuomas Pylkkänen , Keijo Hämäläinen , Arezki Issolah et al.
Physical Review Letters, 2010, 105 (8), pp.086403. ⟨10.1103/PhysRevLett.105.086403⟩
Journal articles hal-00533335v1

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

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

Renormalization factor and effective mass of the two-dimensional electron gas

Markus Holzmann , Bernard Bernu , Valerio Olevano , Richard M. Martin , David M. Ceperley et al.
Physical Review B: Condensed Matter and Materials Physics (1998-2015), 2009, 79 (4), pp.041308(R). ⟨10.1103/PhysRevB.79.041308⟩
Journal articles hal-00438177v1

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
Image document

Coupled Electron Ion Monte Carlo Calculations of Atomic Hydrogen

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

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

The Finite Size Error in Many-body Simulations with long-Ranged Interactions

Simone Chiesa , David M. Ceperley , Richard M. Martin , Markus Holzmann
Physical Review Letters, 2006, 97, pp.076404
Journal articles hal-00107324v1

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
Image document

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