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Binding energies of exciton complexes in transition metal dichalcogenide monolayers and effect of dielectric environment

Physical review. B, Condensed matter and materials physics, 2015-11, Vol.92 (20), Article 205418

2015

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Static field-gradient polarizabilities of small atoms and molecules at finite temperature

The Journal of chemical physics, 2017-11, Vol.147 (20), p.204101-204101

2017

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Computation of Dynamic Polarizabilities and van der Waals Coefficients from Path-Integral Monte Carlo

Journal of chemical theory and computation, 2018-11, Vol.14 (11), p.5750-5763

2018

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Metal–insulator transition tuned by oxygen vacancy migration across TiO2/VO2 interface

Scientific reports, 2020-10, Vol.10 (1), p.18554-18554, Article 18554

2020

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Accuracy of ab initio electron correlation and electron densities in vanadium dioxide

Physical review materials, 2017-11, Vol.1 (6), Article 065408

2017

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QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo

The Journal of chemical physics, 2020-05, Vol.152 (17), p.174105-174105

2020

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Finite temperature quantum statistics of H 3 + molecular ion

The Journal of chemical physics, 2010-07, Vol.133 (4), p.044312-044312-5

2010

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Stability of the Dirac cone in artificial graphene formed in quantum wells: a computational many-electron study

New journal of physics, 2016-08, Vol.18 (8), p.83014

2016

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Exact modeling of finite temperature and quantum delocalization effects on reliability of quantum-dot cellular automata

Journal of physics. D, Applied physics, 2016-01, Vol.49 (6), p.65103-65109

2016

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First-principles simulation of molecular dissociation-recombination equilibrium

The Journal of chemical physics, 2011-09, Vol.135 (10), p.104310-104310-7

2011

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Extended Ewald summation technique

Computer physics communications, 2016-09, Vol.206, p.64-68

2016

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Path integral Monte Carlo benchmarks for two-dimensional quantum dots

Physical review. B, 2017-11, Vol.96 (20), Article 205445

2017

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How large are nonadiabatic effects in atomic and diatomic systems?

The Journal of chemical physics, 2015-09, Vol.143 (12), p.124308-124308

2015

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Doping a bad metal: Origin of suppression of the metal-insulator transition in nonstoichiometric VO2

Physical review. B, 2020-04, Vol.101 (15), p.1

2020

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General polarizability and hyperpolarizability estimators for the path-integral Monte Carlo method applied to small atoms, ions, and molecules at finite temperatures

Physical review. A, 2016-09, Vol.94 (3), Article 032515

2016

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Compton profile of VO2 across the metal-insulator transition: Evidence of a non-Fermi liquid metal

Physical review. B, 2019-02, Vol.99 (7), p.075154

2019

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Beyond the Born-Oppenheimer approximation with quantum Monte Carlo methods

Physical review. A, Atomic, molecular, and optical physics, 2014-10, Vol.90 (4), Article 042507

2014

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Adiabatic and nonadiabatic static polarizabilities of H and H 2

Physical review. A, Atomic, molecular, and optical physics, 2015-06, Vol.91 (6), Article 062503

2015

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Finite temperature quantum statistics of H3+ molecular ion

The Journal of chemical physics, 2010-07, Vol.133 (4)

2010

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Numerical path integral solution to strong Coulomb correlation in one dimensional Hooke’s atom

Computer physics communications, 2017-01, Vol.210, p.45-53

2017

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Coverage dependence of finite temperature quantum distribution of hydrogen on nickel(0 0 1) surface

Surface science, 2007-03, Vol.601 (5), p.1246-1254

2007

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

Physical review. A, Atomic, molecular, and optical physics, 2012-11, Vol.86 (5), Article 052506

2012

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Thermal dissociation of dipositronium: Path-integral Monte Carlo approach

Physical review. A, Atomic, molecular, and optical physics, 2009-08, Vol.80 (2), Article 024504

2009

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Publisher's Note: "Finite temperature quantum statistics of H 3 + molecular ion" [J. Chem. Phys. 133, 044312 (2010)]

The Journal of chemical physics, 2010-09, Vol.133 (9), p.099902-099902-1

2010

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Publisher’s Note: “Finite temperature quantum statistics of H3+ molecular ion” [J. Chem. Phys. 133, 044312 (2010)]

The Journal of chemical physics, 2010-09, Vol.133 (9)

2010

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Binding energies of exciton complexes in transition metal dichalcogenide monolayers and effect of dielectric environment

Static field-gradient polarizabilities of small atoms and molecules at finite temperature

Computation of Dynamic Polarizabilities and van der Waals Coefficients from Path-Integral Monte Carlo

Metal–insulator transition tuned by oxygen vacancy migration across TiO2/VO2 interface

Accuracy of ab initio electron correlation and electron densities in vanadium dioxide

QMCPACK: Advances in the development, efficiency, and application of auxiliary field and real-space variational and diffusion quantum Monte Carlo

Finite temperature quantum statistics of H 3 + molecular ion

Stability of the Dirac cone in artificial graphene formed in quantum wells: a computational many-electron study

Exact modeling of finite temperature and quantum delocalization effects on reliability of quantum-dot cellular automata

First-principles simulation of molecular dissociation-recombination equilibrium

Extended Ewald summation technique

Path integral Monte Carlo benchmarks for two-dimensional quantum dots

How large are nonadiabatic effects in atomic and diatomic systems?

Doping a bad metal: Origin of suppression of the metal-insulator transition in nonstoichiometric VO2

General polarizability and hyperpolarizability estimators for the path-integral Monte Carlo method applied to small atoms, ions, and molecules at finite temperatures

Compton profile of VO2 across the metal-insulator transition: Evidence of a non-Fermi liquid metal

Beyond the Born-Oppenheimer approximation with quantum Monte Carlo methods

Adiabatic and nonadiabatic static polarizabilities of H and H 2

Finite temperature quantum statistics of H3+ molecular ion

Numerical path integral solution to strong Coulomb correlation in one dimensional Hooke’s atom

Coverage dependence of finite temperature quantum distribution of hydrogen on nickel(0 0 1) surface

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

Thermal dissociation of dipositronium: Path-integral Monte Carlo approach

Publisher's Note: "Finite temperature quantum statistics of H 3 + molecular ion" [J. Chem. Phys. 133, 044312 (2010)]

Publisher’s Note: “Finite temperature quantum statistics of H3+ molecular ion” [J. Chem. Phys. 133, 044312 (2010)]

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