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1

The properties of hydrogen and helium under extreme conditions

McMahon, Jeffrey M., Morales, Miguel A., Pierleoni, Carlo, Ceperley, David M.

Journal:

Review of Modern Physics

Year:

2012

Language:

english

File:

PDF, 2.88 MB

english, 2012

2

Free energy methods in coupled electron ion Monte Carlo

Liberatore, Elisa, Morales, Miguel A., Ceperley, David M., Pierleoni, Carlo

Journal:

Molecular Physics

Year:

2011

Language:

english

File:

PDF, 254 KB

english, 2011

3

Towards the Solution of the Many-Electron Problem in Real Materials: Equation of State of the Hydrogen Chain with State-of-the-Art Many-Body Methods

Motta, Mario, Ceperley, David M., Chan, Garnet Kin-Lic, Gomez, John A., Gull, Emanuel, Guo, Sheng, Jiménez-Hoyos, Carlos A., Lan, Tran Nguyen, Li, Jia, Ma, Fengjie, Millis, Andrew J., Prokof’ev, Nikol

Journal:

Physical Review X

Year:

2017

Language:

english

File:

PDF, 1.54 MB

english, 2017

4

Electronic band gaps from quantum Monte Carlo methods

Yang, Yubo, Gorelov, Vitaly, Pierleoni, Carlo, Ceperley, David M., Holzmann, Markus

Journal:

Physical Review B

Year:

2020

File:

PDF, 742 KB

2020

5

Many-body approaches to atoms and molecules in external magnetic fields

Matthew D. Jones, Gerardo Ortiz, David M. Ceperley

Journal:

International Journal of Quantum Chemistry

Year:

1997

Language:

english

File:

PDF, 696 KB

english, 1997

6

High-temperature superconductivity in atomic metallic hydrogen

McMahon, Jeffrey, Ceperley, David

Journal:

Physical Review B

Year:

2011

Language:

english

File:

PDF, 974 KB

english, 2011

7

Exchange-correlation energy for the three-dimensional homogeneous electron gas at arbitrary temperature

Brown, Ethan W., DuBois, Jonathan L., Holzmann, Markus, Ceperley, David M.

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 166 KB

english, 2013

8

Path-Integral Monte Carlo Simulation of the Warm Dense Homogeneous Electron Gas

Brown, Ethan W., Clark, Bryan K., DuBois, Jonathan L., Ceperley, David M.

Journal:

Physical Review Letters

Year:

2013

Language:

english

File:

PDF, 407 KB

english, 2013

9

Quantum energy density: Improved efficiency for quantum Monte Carlo calculations

Krogel, Jaron T., Yu, Min, Kim, Jeongnim, Ceperley, David M.

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 955 KB

english, 2013

10

Momentum Distribution and Renormalization Factor in Sodium and the Electron Gas

Huotari, Simo, Soininen, J. Aleksi, Pylkkänen, Tuomas, Hämäläinen, Keijo, Issolah, Arezki, Titov, Andrey, McMinis, Jeremy, Kim, Jeongnim, Esler, Ken, Ceperley, David M., Holzmann, Markus, Olevano, Val

Journal:

Physical Review Letters

Year:

2010

Language:

english

File:

PDF, 290 KB

english, 2010

11

Quantum Monte Carlo calculation of Compton profiles of solid lithium

Filippi, Claudia, Ceperley, David M.

Journal:

Physical Review B

Year:

1999

Language:

english

File:

PDF, 199 KB

english, 1999

12

Benchmarking exchange-correlation functionals for hydrogen at high pressures using quantum Monte Carlo

Clay, Raymond C., Mcminis, Jeremy, McMahon, Jeffrey M., Pierleoni, Carlo, Ceperley, David M., Morales, Miguel A.

Journal:

Physical Review B

Year:

2014

Language:

english

File:

PDF, 1.79 MB

english, 2014

13

First Principles Methods: A Perspective from Quantum Monte Carlo

Morales, Miguel, Clay, Raymond, Pierleoni, Carlo, Ceperley, David

Journal:

Year:

2013

Language:

english

File:

PDF, 579 KB

english, 2013

14

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

Holzmann, Markus, Clay, Raymond C., Morales, Miguel A., Tubman, Norm M., Ceperley, David M., Pierleoni, Carlo

Journal:

Physical Review B

Year:

2016

Language:

english

File:

PDF, 483 KB

english, 2016

15

Discovering correlated fermions using quantum Monte Carlo

Wagner, Lucas K, Ceperley, David M

Journal:

Reports on Progress in Physics

Year:

2016

Language:

english

File:

PDF, 859 KB

english, 2016

16

The transition to the metallic state in low density hydrogen

McMinis, Jeremy, Morales, Miguel A., Ceperley, David M., Kim, Jeongnim

Journal:

The Journal of Chemical Physics

Year:

2015

Language:

english

File:

PDF, 722 KB

english, 2015

17

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

Kim, Jeongnim, Baczewski, Andrew D, Beaudet, Todd D, Benali, Anouar, Bennett, M Chandler, Berrill, Mark A, Blunt, Nick S, Borda, Edgar Josué Landinez, Casula, Michele, Ceperley, David M, Chiesa, Simon

Journal:

Journal of Physics Condensed Matter

Year:

2018

Language:

english

File:

PDF, 2.39 MB

english, 2018

18

Energy Gap Closure of Crystalline Molecular Hydrogen with Pressure

Gorelov, Vitaly, Holzmann, Markus, Ceperley, David M., Pierleoni, Carlo

Journal:

Physical Review Letters

Year:

2020

Language:

english

File:

PDF, 531 KB

english, 2020

19

Quantum Monte Carlo determination of the principal Hugoniot of deuterium

Ruggeri, Michele, Holzmann, Markus, Ceperley, David M., Pierleoni, Carlo

Journal:

Physical Review B

Year:

2020

File:

PDF, 660 KB

2020

20

Computational Methods in Coupled Electron–Ion Monte Carlo Simulations

Carlo Pierleoni, David M. Ceperley

Journal:

Year:

2005

Language:

english

File:

PDF, 130 KB

english, 2005

21

An Optimized Method for Treating Long-Range Potentials

Vincent Natoli, David M. Ceperley

Journal:

Journal of Computational Physics

Year:

1995

File:

PDF, 318 KB

1995

22

Trial wave functions for high-pressure metallic hydrogen

Carlo Pierleoni, Kris T. Delaney, Miguel A. Morales, David M. Ceperley, Markus Holzmann

Journal:

Computer Physics Communications

Year:

2008

Language:

english

File:

PDF, 416 KB

english, 2008

23

Path integral calculations of vacancies in solid Helium

Bryan K. Clark, David M. Ceperley

Journal:

Computer Physics Communications

Year:

2008

Language:

english

File:

PDF, 791 KB

english, 2008

24

Testing parallel random number generators

Ashok Srinivasan, Michael Mascagni, David Ceperley

Journal:

Parallel Computing

Year:

2003

Language:

english

File:

PDF, 228 KB

english, 2003

25

Path integral Monte Carlo simulations of thin4He films on a H2surface

Marcus Wagner, David M. Ceperley

Journal:

Journal of Low Temperature Physics

Year:

1992

Language:

english

File:

PDF, 175 KB

english, 1992

26

Density fluctuations in liquid4He. Path integrals and maximum entropy

Massimo Boninsegni, David M. Ceperley

Journal:

Journal of Low Temperature Physics

Year:

1996

Language:

english

File:

PDF, 934 KB

english, 1996

27

Path integral Monte Carlo simulations of the melting of molecular hydrogen surfaces

Marcus Wagner, David M. Ceperley

Journal:

Journal of Low Temperature Physics

Year:

1996

Language:

english

File:

PDF, 1.53 MB

english, 1996

28

Path integral monte carlo simulations of H2surfaces

Marcus Wagner, David M. Ceperley

Journal:

Journal of Low Temperature Physics

Year:

1994

Language:

english

File:

PDF, 1.04 MB

english, 1994

29

Path integral monte carlo simulations of thin4He films on a H2surface

Marcus Wagner, David M. Ceperley

Journal:

Journal of Low Temperature Physics

Year:

1994

Language:

english

File:

PDF, 1.83 MB

english, 1994

30

The dissociation energy of He2+

Charles W. Bauschlicher Jr., Harry Partridge, David Ceperley

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 469 KB

english, 1989

31

Coupled Electron–Ion Monte Carlo calculations of atomic hydrogen

Markus Holzmann, Carlo Pierleoni, David M. Ceperley

Journal:

Computer Physics Communications

Year:

2005

Language:

english

File:

PDF, 121 KB

english, 2005

32

10.1038/17011

Ceperley, David

Journal:

Year:

1999

Language:

english

File:

PDF, 165 KB

english, 1999

33

Solid helium: Supersolid: crystal or plastic?

Ceperley, David

Journal:

Year:

2006

Language:

english

File:

PDF, 203 KB

english, 2006

34

Critical Temperature of Bose-Einstein Condensation of Hard-Sphere Gases

Grüter, Peter, Ceperley, David, Laloë, Frank

Journal:

Physical Review Letters

Year:

1997

Language:

english

File:

PDF, 155 KB

english, 1997

35

^{4}He adsorption on a single graphene sheet: Path-integral Monte Carlo study

Kwon, Yongkyung, Ceperley, David M.

Journal:

Physical Review B

Year:

2012

Language:

english

File:

PDF, 1.04 MB

english, 2012

36

Ground-State Structures of Atomic Metallic Hydrogen

McMahon, Jeffrey, Ceperley, David

Journal:

Physical Review Letters

Year:

2011

Language:

english

File:

PDF, 1.19 MB

english, 2011

37

Electronic energy functionals: Levy–Lieb principle within the ground state path integral quantum Monte Carlo

Luigi Delle Site, Luca M. Ghiringhelli, David M. Ceperley

Journal:

International Journal of Quantum Chemistry

Year:

2012

Language:

english

File:

PDF, 204 KB

english, 2012

38

Improved Scaling for Quantum Monte Carlo on Insulators

Ahuja, Kapil, Clark, Bryan K., de Sturler, Eric, Ceperley, David M., Kim, Jeongnim

Journal:

SIAM Journal on Scientific Computing

Year:

2011

Language:

english

File:

PDF, 1.76 MB

english, 2011

39

Few-body reference data for multicomponent formalisms: Light-nuclei molecules

Kylänpää, Ilkka, Rantala, Tapio T., Ceperley, David M.

Journal:

Physical Review A

Year:

2012

Language:

english

File:

PDF, 148 KB

english, 2012

40

Nuclear Quantum Effects and Nonlocal Exchange-Correlation Functionals Applied to Liquid Hydrogen at High Pressure

Morales, Miguel A., McMahon, Jeffrey M., Pierleoni, Carlo, Ceperley, David M.

Journal:

Physical Review Letters

Year:

2013

Language:

english

File:

PDF, 245 KB

english, 2013

41

Towards a predictive first-principles description of solid molecular hydrogen with density functional theory

Morales, Miguel A., McMahon, Jeffrey M., Pierleoni, Carlo, Ceperley, David M.

Journal:

Physical Review B

Year:

2013

Language:

english

File:

PDF, 530 KB

english, 2013

42

Revealing the condensate and noncondensate distributions in the inhomogeneous Bose-Hubbard model

Ray, Ushnish, Ceperley, David M.

Journal:

Physical Review A

Year:

2013

Language:

english

File:

PDF, 1.31 MB

english, 2013

43

Electronic structure and many-body effects in self-assembled quantum dots

Leburton, Jean-Pierre, Fonseca, Leonardo R C, Nagaraja, Satyadev, Shumway, John, Ceperley, David, Martin, Richard M

Journal:

Journal of Physics Condensed Matter

Year:

1999

Language:

english

File:

PDF, 277 KB

english, 1999

44

Path integral Monte Carlo study of SF6-doped helium clusters

Kwon, Yongkyung, Ceperley, David M., Whaley, K. Birgitta

Journal:

The Journal of Chemical Physics

Year:

1996

Language:

english

File:

PDF, 348 KB

english, 1996

45

Quantum Monte Carlo Benchmark of Exchange-Correlation Functionals for Bulk Water

Morales, Miguel A., Gergely, John R., McMinis, Jeremy, McMahon, Jeffrey M., Kim, Jeongnim, Ceperley, David M.

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 968 KB

english, 2014

46

Quantum mechanical simulation of liquids

Alder, Berni J., Ceperley, David M., Pollock, Edwin L.

Journal:

Accounts of Chemical Research

Year:

1985

Language:

english

File:

PDF, 1.39 MB

english, 1985

47

Nonlocal pseudopotentials and diffusion Monte Carlo

Mitáš, Luboš, Shirley, Eric L., Ceperley, David M.

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 1000 KB

english, 1991

48

Investigations of static properties of model bulk polymer fluids

Bishop, Marvin, Ceperley, David, Frisch, H. L., Kalos, M. H.

Journal:

The Journal of Chemical Physics

Year:

1980

Language:

english

File:

PDF, 712 KB

english, 1980

49

Released-phase quantum Monte Carlo method

Jones, Matthew D., Ortiz, Gerardo, Ceperley, David M.

Journal:

Physical Review E

Year:

1997

Language:

english

File:

PDF, 279 KB

english, 1997

50

Itinerant ferromagnetism in a Fermi gas with contact interaction: Magnetic properties in a dilute Hubbard model

Chang, Chia-Chen, Zhang, Shiwei, Ceperley, David M.

Journal:

Physical Review A

Year:

2010

Language:

english

File:

PDF, 938 KB

english, 2010