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Comparison of the Properties of Xenon, Methane, and Carbon Dioxide Hydrates from Equilibrium and Nonequilibrium Molecular Dynamics Simulations

Journal of physical chemistry. C, 2010-04, Vol.114 (12), p.5555-5564

2010

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Infrared Spectroscopy of Small Protonated Water Clusters, H+(H2O) n (n = 2−5): Isomers, Argon Tagging, and Deuteration

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2010-04, Vol.114 (13), p.4570-4579

2010

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Infrared Signature of Structures Associated with the$H^+(H_{2}O)_n$(n = 6 to 27) Clusters

Science (American Association for the Advancement of Science), 2004-05, Vol.304 (5674), p.1137-1140

2004

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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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Binding of an Electron by a Finite Fixed Dipole

The journal of physical chemistry letters, 2022-11, Vol.13 (44), p.10331-10334

2022

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Molecular Dynamics Simulations of Methane Hydrate Using Polarizable Force Fields

The journal of physical chemistry. B, 2007-06, Vol.111 (23), p.6486-6492

2007

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Application of the Diffusion Monte Carlo Method to the Binding of Excess Electrons to Water Clusters

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2010-01, Vol.114 (3), p.1364-1366

2010

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A Modified MSEVB Force Field for Protonated Water Clusters

The journal of physical chemistry. B, 2009-04, Vol.113 (13), p.4111-4118

2009

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Estimating the Strength of the Water/Single-Layer Graphite Interaction

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2000-11, Vol.104 (44), p.9971-9975

2000

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Infrared Spectrum and Structural Assignment of the Water Trimer Anion

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2005-12, Vol.109 (50), p.11526-11530

2005

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Application of a Drude model to the binding of excess electrons to water clusters

The Journal of chemical physics, 2002-04, Vol.116 (16), p.6973-6981

2002

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Mental Health First Aid for Black Populations: Recommendations From the Neighborhood Healers Project

The Counseling psychologist, 2024-08, Vol.52 (6), p.901-932

2024

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Comparison of Density Functional and MP2 Calculations on the Water Monomer and Dimer

Journal of physical chemistry (1952), 1994-10, Vol.98 (40), p.10089-10094

1994

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Finite Temperature Behavior of H+(H2O)6 and H+(H2O)8

The journal of physical chemistry. B, 2002-08, Vol.106 (33), p.8376-8381

2002

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Infrared Photodissociation Spectroscopy of Mg+(H2O)Ar n Complexes: Isomers in Progressive Microsolvation

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2005-08, Vol.109 (32), p.7057-7067

2005

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Concerted Use of Slab and Cluster Models in an ab Initio Study of Hydrogen Desorption from the Si(100) Surface

The journal of physical chemistry. B, 2001-05, Vol.105 (18), p.4031-4038

2001

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Infrared Signature of Structures Associated with the H(+) (H2O)(sub n) (n = 6 to 27) Clusters

Science (American Association for the Advancement of Science), 2004-05, Vol.304 (5674), p.1137-1140

2004

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Theoretical study of the (H 2O) 6 cluster

Chemical physics letters, 1993-10, Vol.213 (1), p.181-188

1993

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Spectral differences in real-space electronic structure calculations

The Journal of chemical physics, 2004-01, Vol.120 (2), p.574-578

2004

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Monte Carlo simulation of (H2O)8 : evidence for a low-energy S4 structure and characterization of the solid ↔ liquid transition

The Journal of chemical physics, 1991-09, Vol.95 (5), p.3850-3853

1991

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Use of the histogram and jump-walking methods for overcoming slow barrier crossing behavior in Monte Carlo simulations : applications to the phase transitions in the (Ar)13 and (H2O)8 clusters

The Journal of chemical physics, 1993-11, Vol.99 (9), p.6957-6970

1993

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The Minor Arts of Daily Life: Popular Culture in Taiwan

1, 2004

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Theoretical study of the low-lying triplet and singlet states of tetramethyleneethane: prediction of a triplet below singlet state at the triplet equilibrium geometry

Journal of the American Chemical Society, 1993-01, Vol.115 (1), p.270-271

1993

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Theoretical Calculations of Voltage-Dependent STM Images of Acetylene on the Si(001) Surface

The journal of physical chemistry. B, 2002-02, Vol.106 (6), p.1316-1321

2002

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Negative ions of ethylene sulfite

The Journal of chemical physics, 2005-05, Vol.122 (20), p.204319-204319

2005

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Comparison of the Properties of Xenon, Methane, and Carbon Dioxide Hydrates from Equilibrium and Nonequilibrium Molecular Dynamics Simulations

Infrared Spectroscopy of Small Protonated Water Clusters, H+(H2O) n (n = 2−5): Isomers, Argon Tagging, and Deuteration

Infrared Signature of Structures Associated with the$H^+(H_{2}O)_n$(n = 6 to 27) Clusters

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

Binding of an Electron by a Finite Fixed Dipole

Molecular Dynamics Simulations of Methane Hydrate Using Polarizable Force Fields

Application of the Diffusion Monte Carlo Method to the Binding of Excess Electrons to Water Clusters

A Modified MSEVB Force Field for Protonated Water Clusters

Estimating the Strength of the Water/Single-Layer Graphite Interaction

Infrared Spectrum and Structural Assignment of the Water Trimer Anion

Application of a Drude model to the binding of excess electrons to water clusters

Mental Health First Aid for Black Populations: Recommendations From the Neighborhood Healers Project

Comparison of Density Functional and MP2 Calculations on the Water Monomer and Dimer

Finite Temperature Behavior of H+(H2O)6 and H+(H2O)8

Infrared Photodissociation Spectroscopy of Mg+(H2O)Ar n Complexes: Isomers in Progressive Microsolvation

Concerted Use of Slab and Cluster Models in an ab Initio Study of Hydrogen Desorption from the Si(100) Surface

Infrared Signature of Structures Associated with the H(+) (H2O)(sub n) (n = 6 to 27) Clusters

Theoretical study of the (H 2O) 6 cluster

Spectral differences in real-space electronic structure calculations

Monte Carlo simulation of (H2O)8 : evidence for a low-energy S4 structure and characterization of the solid ↔ liquid transition

Use of the histogram and jump-walking methods for overcoming slow barrier crossing behavior in Monte Carlo simulations : applications to the phase transitions in the (Ar)13 and (H2O)8 clusters

The Minor Arts of Daily Life: Popular Culture in Taiwan

Theoretical study of the low-lying triplet and singlet states of tetramethyleneethane: prediction of a triplet below singlet state at the triplet equilibrium geometry

Theoretical Calculations of Voltage-Dependent STM Images of Acetylene on the Si(001) Surface

Negative ions of ethylene sulfite

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