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Adsorption of Polyvinylpyrrolidone on Ag Surfaces: Insight into a Structure-Directing Agent

Nano letters, 2012-02, Vol.12 (2), p.997-1001

2012

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Density Functional Theory Study of Pyrophyllite and M-Montmorillonites (M = Li, Na, K, Mg, and Ca): Role of Dispersion Interactions

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-09, Vol.115 (34), p.9695-9703

2011

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Resonance Raman Spectra of TNT and RDX Using Vibronic Theory, Excited-State Gradient, and Complex Polarizability Approximations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2012-08, Vol.116 (30), p.7862-7872

2012

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An Assessment of the vdW-TS Method for Extended Systems

Journal of chemical theory and computation, 2012-04, Vol.8 (4), p.1503-1513

2012

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Dispersion-Corrected Density Functional Theory and Classical Force Field Calculations of Water Loading on a Pyrophyllite(001) Surface

Journal of physical chemistry. C, 2012-08, Vol.116 (32), p.17134-17141

2012

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Assessment of the performance of common density functional methods for describing the interaction energies of (H2O)6 clusters

The Journal of chemical physics, 2010-04, Vol.132 (13), p.134303-134303

2010

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Evaluation of Theoretical Approaches for Describing the Interaction of Water with Linear Acenes

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-06, Vol.115 (23), p.5955-5964

2011

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Theoretical and experimental study of temperature effect on electronic and optical properties of TiO2: comparing rutile and anatase

Journal of physics. Condensed matter, 2020-07, Vol.32 (40)

2020

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The role of van der Waals interactions in the adsorption of noble gases on metal surfaces

Journal of physics. Condensed matter, 2012-10, Vol.24 (42), p.424211-424211

2012

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Auxiliary-field quantum Monte Carlo calculations of molecular systems with a Gaussian basis

The Journal of chemical physics, 2006-06, Vol.124 (22), p.224101-224101-10

2006

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Bond breaking with auxiliary-field quantum Monte Carlo

The Journal of chemical physics, 2007-10, Vol.127 (14), p.144101-144101-8

2007

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Eliminating spin contamination in auxiliary-field quantum Monte Carlo: Realistic potential energy curve of F2

The Journal of chemical physics, 2008-03, Vol.128 (11)

2008

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Variational and diffusion Monte Carlo study of post- d group 13-17 elements

The Journal of chemical physics, 2008-08, Vol.129 (6), p.064316-064316-7

Al-Saidi, W. A.

2008

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Thermal Dehydration and Vibrational Spectra of Hydrated Sodium Metaborates

Industrial & engineering chemistry research, 2011-07, Vol.50 (13), p.7746-7752

2011

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Auxiliary-field quantum Monte Carlo study of first- and second-row post- d elements

The Journal of chemical physics, 2006-10, Vol.125 (15), p.154110-154110-10

2006

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A study of H+H2 and several H-bonded molecules by phaseless auxiliary-field quantum Monte Carlo with plane wave and Gaussian basis sets

The Journal of chemical physics, 2007-05, Vol.126 (19), p.194105-194105

2007

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Fixed-node diffusion Monte Carlo study of the structures of m -benzyne

The Journal of chemical physics, 2008-04, Vol.128 (15), p.154324-154324-4

2008

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Several small Josephson junctions in a resonant cavity: Deviation from the Dicke model

Physical review. B, Condensed matter, 2002-06, Vol.65 (22), Article 224512

2002

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Quantum Monte Carlo study of a disordered 2D Josephson junction array

Physica. C, Superconductivity, 2004-02, Vol.402 (1), p.216-222

2004

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Auxiliary-field quantum Monte Carlo study of TiO and MnO molecules

Physical review. B, Condensed matter and materials physics, 2006-02, Vol.73 (7), Article 075103

2006

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Ground state structure of BNB using fixed-node diffusion Monte Carlo

Chemical physics letters, 2012-08, Vol.543, p.41-44

Al-Saidi, W.A.

2012

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Langevin vortex dynamics for a layered superconductor in the lowest-Landau-level approximation

Physical review. B, Condensed matter, 2003-10, Vol.68 (14), Article 144511

2003

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Eigenstates of a small Josephson junction coupled to a resonant cavity

Physical review. B, Condensed matter, 2002-01, Vol.65 (1), Article 014512

2002

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Eliminating spin contamination in auxiliary-field quantum Monte Carlo:Realistic potential energy curve of F 2

The Journal of chemical physics, 2008-03, Vol.128 (11), p.114309-114309-7

2008

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A study of H + H 2 and several H-bonded molecules by phaseless auxiliary-field quantum Monte Carlo with plane wave and Gaussian basis sets

The Journal of chemical physics, 2007-05, Vol.126 (19), p.194105-194105-8

2007

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Adsorption of Polyvinylpyrrolidone on Ag Surfaces: Insight into a Structure-Directing Agent

Density Functional Theory Study of Pyrophyllite and M-Montmorillonites (M = Li, Na, K, Mg, and Ca): Role of Dispersion Interactions

Resonance Raman Spectra of TNT and RDX Using Vibronic Theory, Excited-State Gradient, and Complex Polarizability Approximations

An Assessment of the vdW-TS Method for Extended Systems

Dispersion-Corrected Density Functional Theory and Classical Force Field Calculations of Water Loading on a Pyrophyllite(001) Surface

Assessment of the performance of common density functional methods for describing the interaction energies of (H2O)6 clusters

Evaluation of Theoretical Approaches for Describing the Interaction of Water with Linear Acenes

Theoretical and experimental study of temperature effect on electronic and optical properties of TiO2: comparing rutile and anatase

The role of van der Waals interactions in the adsorption of noble gases on metal surfaces

Auxiliary-field quantum Monte Carlo calculations of molecular systems with a Gaussian basis

Bond breaking with auxiliary-field quantum Monte Carlo

Eliminating spin contamination in auxiliary-field quantum Monte Carlo: Realistic potential energy curve of F2

Variational and diffusion Monte Carlo study of post- d group 13-17 elements

Thermal Dehydration and Vibrational Spectra of Hydrated Sodium Metaborates

Auxiliary-field quantum Monte Carlo study of first- and second-row post- d elements

A study of H+H2 and several H-bonded molecules by phaseless auxiliary-field quantum Monte Carlo with plane wave and Gaussian basis sets

Fixed-node diffusion Monte Carlo study of the structures of m -benzyne

Several small Josephson junctions in a resonant cavity: Deviation from the Dicke model

Quantum Monte Carlo study of a disordered 2D Josephson junction array

Auxiliary-field quantum Monte Carlo study of TiO and MnO molecules

Ground state structure of BNB using fixed-node diffusion Monte Carlo

Langevin vortex dynamics for a layered superconductor in the lowest-Landau-level approximation

Eigenstates of a small Josephson junction coupled to a resonant cavity

Eliminating spin contamination in auxiliary-field quantum Monte Carlo:Realistic potential energy curve of F 2

A study of H + H 2 and several H-bonded molecules by phaseless auxiliary-field quantum Monte Carlo with plane wave and Gaussian basis sets

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