J. Kress

发表

Kernel Polynomial Approximations for Densities of States and Spectral Functions

A. Voter, R. Silver, H. Roeder, 1996 .

Molecular and solid-state properties of tris-(8-hydroxyquinolate)-aluminum

Richard L. Martin, J. Kress, I. Campbell, 2000 .

The Mechanism of CO2 Adsorption under Dry and Humid Conditions in Mesoporous Silica-Supported Amine Sorbents

Joel D. Kress, Kuijun Li, David S. Mebane, 2016 .

The hydration number of Li{sup +} in liquid water

Richard L. Martin, J. Kress, G. Hummer, 2000 .

Molecular dynamics simulations of compressed hydrogen

J. Kress, T. Lenosky, S. Bickham, 2000 .

Density-functional calculation of the Hugoniot of shocked liquid deuterium

J. Kress, T. Lenosky, S. Bickham, 2000 .

Evidence for out-of-equilibrium states in warm dense matter probed by x-ray Thomson scattering.

J. Kress, C. Ticknor, L. Collins, 2014, Physical review. E, Statistical, nonlinear, and soft matter physics.

Transport properties of lithium hydride from quantum molecular dynamics and orbital-free molecular dynamics

J. Kress, L. Collins, D. Horner, 2009 .

Viscosity and mutual diffusion of deuterium-tritium mixtures in the warm-dense-matter regime.

J. Kress, L. Collins, D. Horner, 2010, Physical review. E, Statistical, nonlinear, and soft matter physics.

Behavior of the coupling parameter under isochoric heating in a high-Z plasma.

J. Kress, L. Collins, J. Clérouin, 2013, Physical review. E, Statistical, nonlinear, and soft matter physics.

Effect of correlation on viscosity and diffusion in molecular-dynamics simulations.

J. Kress, C. Ticknor, L. Collins, 2014, Physical review. E, Statistical, nonlinear, and soft matter physics.

Unified Concept of Effective One Component Plasma for Hot Dense Plasmas.

J. Kress, C. Ticknor, L. Collins, 2016, Physical review letters.

Correlation and transport properties for mixtures at constant pressure and temperature.

J. Kress, N. Desbiens, A. White, 2017, Physical review. E.

Review of the first charged-particle transport coefficient comparison workshop

J. Kress, M. Desjarlais, S. Hansen, 2020, 2007.00744.

Electrical conductivity for warm, dense aluminum plasmas and liquids.

J. Kress, M. Desjarlais, L. Collins, 2002, Physical review. E, Statistical, nonlinear, and soft matter physics.

Calculations of the thermal conductivity of National Ignition Facility target materials at temperatures near 10 eV and densities near 10 g/cc using finite-temperature quantum molecular dynamics

J. Kress, M. Desjarlais, L. Collins, 2011 .

First-principles thermal conductivity of warm-dense deuterium plasmas for inertial confinement fusion applications.

J. Kress, T. Boehly, V. Goncharov, 2014, Physical review. E, Statistical, nonlinear, and soft matter physics.

Accurate three-dimensional quantum scattering calculations for F + H2 → HF + H with total angular momentum J = 1

J. Kress, G. A. Parker, R. T. Pack, 1990 .

Combined x-ray scattering, radiography, and velocity interferometry/streaked optical pyrometry measurements of warm dense carbon using a novel technique of shock-and-releasea)

J. Kress, J. Benage, D. Montgomery, 2014 .

Structural stability and lattice defects in copper: Ab initio , tight-binding, and embedded-atom calculations

Arthur F. Voter, Michael J. Mehl, Joel D. Kress, 2001 .

Theoretical studies of H2 desorption processes in chemical vapor deposition of boron-doped silicon surfaces

Richard L. Martin, J. Kress, P. Hay, 1999 .

Average atom transport properties for pure and mixed species in the hot and warm dense matter regimes

J. Kress, V. Recoules, L. Collins, 2012 .

Multicomponent mutual diffusion in the warm, dense matter regime.

J. Kress, C. Ticknor, L. Collins, 2019, Physical review. E.

Excitation and ionization of molecules by a single-mode laser field using a time-dependent approach

J. Kress, L. Collins, R. Walker, 1998 .

Energy relaxation rates in dense hydrogen plasmas.

J. Kress, Niels Grønbech-Jensen, J. Colgan, 2008, Physical review. E, Statistical, nonlinear, and soft matter physics.

First-principles studies on the equation of state, thermal conductivity, and opacity of deuterium-tritium (DT) and polystyrene (CH) for inertial confinement fusion applications

J. Kress, T. Boehly, V. Goncharov, 2016 .

Molecular and atomic oxygen on unpromoted and cesium promoted Ag(111) surfaces

J. Kress, A. Redondo, C. Saravanan, 2000 .

Dissociation of molecular oxygen on unpromoted and cesium‐promoted Ag(111) surfaces

J. Kress, A. Redondo, M. R. Salazar, 2000 .

Coarse-grained rigid blob model for soft matter simulations.

J. Kress, A. Redondo, S. Chao, 2005, The Journal of chemical physics.

Calculation of a deuterium double shock Hugoniot from ab initio simulations.

J. Kress, B. Militzer, D. Ceperley, 2001, Physical review letters.

Simulations of the optical properties of warm dense aluminum.

N. H. Magee, J. Kress, M. Desjarlais, 2005, Physical review. E, Statistical, nonlinear, and soft matter physics.

Checking the Salpeter enhancement of nuclear reactions at intermediate coupling in asymmetric mixtures

J. Kress, N. Desbiens, A. White, 2018, Physics of Plasmas.

Self‐Organization in Dense Plasmas: The Gamma‐Plateau

J. Kress, C. Ticknor, L. Collins, 2015 .

Transport properties of an asymmetric mixture in the dense plasma regime.

J. Kress, C. Ticknor, L. Collins, 2016, Physical review. E.

The quantum hypernetted chain model of warm dense matter

J. Kress, D. Saumon, C. Starrett, 2012 .

Molecular-dynamics modeling of the Hugoniot of shocked liquid deuterium

J. Kress, T. Lenosky, L. Collins, 1997 .

Quantum molecular dynamics simulations of warm dense lithium hydride: Examination of mixing rules

J. Kress, L. Collins, D. Horner, 2008 .

Quantum Molecular Dynamics calculations of radiative opacities

N. H. Magee, J. Kress, S. Mazevet, 2003 .

Molecular Dynamics Modeling of Dense Hydrogen

J. Kress, T. Lenosky, N. Troullier, 2002 .

Simulations of Molecular Fluids under Extreme Conditions

J. Kress, S. Mazevet, L. Collins, 2001 .

Quantum molecular dynamics simulations of shocked nitrogen oxide

J. Kress, S. Mazevet, L. Collins, 2004 .

Quantum molecular-dynamics study of the electrical and optical properties of shocked liquid nitrogen

J. Kress, S. Mazevet, L. Collins, 2003 .

Dynamical and transport properties of liquid gallium at high pressures.

J. Kress, T. Germann, K. Kadau, 2015, Physical review. E, Statistical, nonlinear, and soft matter physics.

Parallel O(N) tight-binding molecular dynamics of polyethylene and compressed methane

J. Kress, S. Goedecker, O. Lubeck, 1998 .

Dissociation of molecular oxygen on unpromoted and cesium promoted Ag(110) surfaces

J. Kress, A. Redondo, M. R. Salazar, 2000 .

Quantum scattering studies of long‐lived resonances for the reaction Ne+H+2→NeH++H

E. F. Hayes, J. Kress, P. Pendergast, 1994 .

Mixed direct-iterative methods for boundary integral formulations of dielectric solvation models.

J. Kress, L. Pratt, G. Tawa, 1995, Pacific Symposium on Biocomputing. Pacific Symposium on Biocomputing.

Preliminary Assessment of Post-Combustion Capture of Carbon Dioxide at the San Juan Generating Station

J. Kress, M. Dubey, R. Middleton, 2019 .

Liquid Chromatography Quadrupole Time-of-Flight Mass Spectrometry Analysis of Eutectic Bis(2,2-dinitropropyl) Acetal/Formal Degradation Profile: Nontargeted Identification of Antioxidant Derivatives

J. Kress, Julie Jung, Kitmin Chen, 2022, ACS omega.

Water adsorption and dissociation on BeO (001) and (100) surfaces

J. Kress, L. Pratt, D. Asthagiri, 2007, physics/0701269.

Calculation of a deuterium double shock Hugoniot from ab initio simulations.

J. Kress, B. Militzer, D. Ceperley, 2001, Physical review letters.

Simulations of fluid hydrogen: comparison of a dissociation model with tight-binding molecular dynamics.

J. Kress, T. Lenosky, R. Redmer, 1999, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.

MOLECULAR-DYNAMICS MODELING OF SHOCK-COMPRESSED LIQUID HYDROGEN

J. Kress, T. Lenosky, L. Collins, 1997 .

Quantum-Molecular-Dynamics Simulations of Isotopic Mixtures of Dense, Hot Hydrogen

J. Kress, N. Troullier, L. Collins, 1995 .

Molecular dynamics simulations of dense plasmas

J. Kress, N. Troullier, L. Collins, 1993 .

Some strategies for enhancing the performance of the block Lanczos method

Gregory A. Parker, Joel D. Kress, S. B. Woodruff, 1989 .

Free energy of liquid water on the basis of quasichemical theory and ab initio molecular dynamics.

J. Kress, L. Pratt, D. Asthagiri, 2003, Physical review. E, Statistical, nonlinear, and soft matter physics.

Determination of the headgroup-gold(111) potential surface for alkanethiol self-assembled monolayers by ab initio calculation

J. Kress, Niels Grønbech-Jensen, A. Bishop, 1998 .

Ab-initio calculations of the gold-sulfur interaction for alkanethiol monolayers

J. Kress, Niels Grønbech-Jensen, A. Bishop, 1997 .

Direct calculation of collisional properties that require energy derivatives of the S matrix: Results for the reaction He+H+2⇌HeH++H

E. F. Hayes, J. Kress, G. A. Parker, 1991 .

Quantum reactive scattering in three dimensions using hyperspherical (APH) coordinates. 5. Comparison between two accurate potential energy surfaces for hydrogen atom + hydrogen and deuterium atom + hydrogen

J. Kress, G. A. Parker, R. T. Pack, 1990 .

The hydration state of HO - (aq)

J. Kress, L. Pratt, D. Asthagiri, 2003, physics/0305113.

Ion solid surface interactions in ionized copper physical vapor deposition

A. Voter, J. Kress, M. Daw, 2002 .

Trapping and desorption of energetic Cu atoms on Cu(111) and (001) surfaces at grazing incidence

A. Voter, J. Kress, D. Hanson, 1999 .

Corrected effective medium method. 3. Application to clusters of magnesium and copper

J. Kress, A. Depristo, M. Stave, 1989 .

Evolution of ultracold neutral plasmas.

J. Kress, S. Mazevet, L. Collins, 2001, Physical review letters.

AN INTERATOMIC POTENTIAL FOR REACTIVE ION ETCHING OF SI BY CL IONS

A. Voter, J. Kress, D. Hanson, 1999 .

First-principles investigations on ionization and thermal conductivity of polystyrene for inertial confinement fusion applications

J. Kress, V. Goncharov, R. Mccrory, 2016 .

Impact of first-principles properties of deuterium–tritium on inertial confinement fusion target designsa)

S. Skupsky, Robert L. McCrory, Burkhard Militzer, 2015 .

Density-functional calculation of multiple-shock Hugoniots of liquid nitrogen

J. Kress, J. D. Johnson, S. Mazevet, 2001 .

Modeling Effects of Annealing on Coal Char Reactivity to O2 and CO2, Based on Preparation Conditions

J. Kress, J. Gattiker, T. Fletcher, 2017 .

Influence of The Local Microstructure on The Macroscopic Properties of Si 1-x-y Ge x C y , Alloys

A. Voter, J. Kress, O. Sankey, 1997 .

Accurate three-dimensional quantum scattering calculations for Ne + H+2 → NeH+ + H

J. Kress, 1991 .

Quantum reactive scattering in three dimensions using hyperspherical (APH) coordinates. IV. Discrete variable representation (DVR) basis functions and the analysis of accurate results for F+H2

J. Kress, G. A. Parker, R. T. Pack, 1990 .

Accurate three‐dimensional quantum scattering studies of long‐lived resonances for the reaction He+H+2→HeH++H

E. F. Hayes, J. Kress, R. Walker, 1990 .

Interactions and structure of poly(dimethylsiloxane) at silicon dioxide surfaces: Electronic structure and molecular dynamics studies

J. Kress, G. Grest, S. Sides, 2003 .

Molecular dynamics simulations of ion self-sputtering of Ni and Al surfaces

J. Kress, B. Stephens, D. Hanson, 2001 .

Comparison of variational Rice–Ramsperger–Kassel–Marcus theory with quantum scattering theory for the He+H+2 →HeH++H reaction

J. Kress, S. Klippenstein, 1992 .

Exact Quantum Results for Reactive Scattering using Hyperspherical (APH) Coordinates

Antonio Laganà, Gregory A. Parker, Joel D. Kress, 1989 .

Thermal Stability of a Eutectic Mixture of Bis(2,2‐dinitropropyl) Acetal and Formal: Part C. Kinetic Compensation Effect

J. Kress, Dali Yang, A. Edgar, 2020 .

A theoretical study of bond energies in model Si–H–Cl molecules using density functional approaches for representing Si surface chemistry

J. Kress, P. Hay, R. Boehm, 1997 .

Orbital-free molecular dynamics simulations of transport properties in dense-plasma uranium

J. Kress, D. Kilcrease, L. Collins, 2011 .

Germanium Multiphase Equation of State

J. Kress, S. Crockett, S. Rudin, 2013 .

Alternative first-principles calculation of entropy for liquids.

J. Kress, C. Ticknor, L. Collins, 2016, Physical review. E.

CONTROLLING CHARGE INJECTION IN ORGANIC ELECTRONIC DEVICES USING SELF-ASSEMBLED MONOLAYERS

Richard L. Martin, John P. Ferraris, Joel D. Kress, 1997 .

MOLECULAR DYNAMICS SIMULATION OF REACTIVE ION ETCHING OF SI BY ENERGETIC CL IONS

A. Voter, J. Kress, D. Hanson, 1997 .

First-principles investigation of radiation induced defects in Si and SiC

A. Voter, J. Kress, T. Lenosky, 1998 .

Simulation of growth of Cu on Ag(001) at experimental deposition rates

J. A. Sprague, Blas P. Uberuaga, Arthur F. Voter, 2002 .

Quantum Molecular Dynamics Simulations of Dense Matter

J. Kress, T. Lenosky, S. Bickham, 1999 .

Hydration and mobility of HO-(aq).

J. Kress, L. Pratt, D. Asthagiri, 2002, Proceedings of the National Academy of Sciences of the United States of America.

Rational function representation for accurate exchange energy functionals

Joel D. Kress, J. Kress, Andrew E. DePristo, 1987 .

Quantum effects in the F+H2→HF+H reaction. Accurate 3D calculations with a realistic potential energy surface

J. Kress, G. A. Parker, R. T. Pack, 1989 .

Accurate three‐dimensional quantum scattering calculations for the F+H2 reaction on a new potential energy surface

J. Kress, 1993 .

Ab initio molecular dynamics and quasichemical study of H+(aq).

J. Kress, L. Pratt, D. Asthagiri, 2005, Proceedings of the National Academy of Sciences of the United States of America.

Highly optimized empirical potential model of silicon

Arthur F. Voter, Babak Sadigh, Vasily V. Bulatov, 2000 .

Highly optimized tight-binding model of silicon

Arthur F. Voter, James B. Adams, Joel D. Kress, 1997 .

First-principles prediction of the softening of the silicon shock Hugoniot curve

J. Kress, B. Militzer, S. X. Hu, 2016, 1608.07517.

Comparison of Lanczos and subspace iterations for hyperspherical reaction path calculations

W. A. Cook, J. Kress, G. A. Parker, 1989 .

Comparison of transition state theory with quantum scattering theory for the reaction Li+HF→LiF+H

J. Kress, G. A. Parker, R. T. Pack, 1994 .

Model description of transition metals using the rotated second moment approximation

A. Voter, J. Kress, 1994 .

Molecular dynamics-based ion-surface interaction models for ionized physical vapor deposition feature scale simulations

Xiang-Yang Liu, Arthur F. Voter, Daniel G. Coronell, 1998 .

An alternative multipolar expansion for intermolecular potential functions.

J. Kress, A. Redondo, S. Chao, 2004, The Journal of chemical physics.

Static and dynamic properties of multi-ionic plasma mixtures.

J. Kress, A. White, C. Ticknor, 2020, Physical review. E.

Corrected effective medium method. II. N‐body formulation

J. Kress, A. Depristo, 1988 .

Molecular dynamics simulation of Cu and Ar ion sputtering of Cu (111) surfaces

A. Voter, J. Kress, D. Hanson, 1999 .

A mechanism for the decomposition of dinitropropyl compounds.

J. Kress, N. Henson, D. Pauler, 2007, Physical Chemistry, Chemical Physics - PCCP.

Low-temperature oxidative degradation of PBX 9501 and its components determined via molecular weight analysis of the Poly[ester urethane] binder

J. Kress, M. R. Salazar, J. M. Lightfoot, 2009 .

Experimental Study of the Oxidative Degradation of PBX 9501 and its Components

J. Kress, M. R. Salazar, J. M. Lightfoot, 2008 .

Enhancement factor of nuclear reactions in partially ionized plasmas and asymmetric mixtures

J. Kress, N. Desbiens, A. White, 2019, Contributions to Plasma Physics.

Mott Transition in a Metallic Liquid: Gutzwiller Molecular Dynamics Simulations.

J. Kress, G. Kotliar, K. Barros, 2015, Physical review letters.

Planetary Ices and the Linear Mixing Approximation

J. Kress, J. Fortney, R. Redmer, 2017, The Astrophysical Journal.

Transport, zwitterions, and the role of water for CO2 adsorption in mesoporous silica-supported amine sorbents

Curtis B. Storlie, Joel D. Kress, D. J. Fauth, 2013 .

Semiclassical Gaussian wave packet dynamics for collinear reactive scattering

J. Kress, A. Depristo, 1988 .

Quantum molecular dynamics simulations of liquid alkalies

J. Kress, N. Troullier, L. Collins, 1994 .

Parallel TREE code for two-component ultracold plasma analysis

Niels Grønbech-Jensen, Byoungseon Jeon, Joel D. Kress, 2007, Comput. Phys. Commun..

Simulation of impurity line shapes in a hot, dense plasma

J. Kress, L. Collins, I. Kwon, 1995 .

Sequential Design of Experiments to Maximize Learning from Carbon Capture Pilot Plant Testing

Debangsu Bhattacharyya, Christine M. Anderson-Cook, James R. Gattiker, 2018 .

Combining Kohn-Sham and orbital-free density-functional theory for Hugoniot calculations to extreme pressures.

J. Kress, M. Desjarlais, S. Crockett, 2014, Physical review. E, Statistical, nonlinear, and soft matter physics.

Quantum molecular dynamics Simulations of dense plasmas

J. Kress, M. Desjarlais, S. Mazevet, 2005, IEEE Transactions on Plasma Science.

ACCELERATED AGING AND CHARACTERIZATION OF A PLASTICIZED POLY(ESTER URETHANE) BINDER

E. B. Orler, J. Kress, D. A. Wrobleski, 2007 .

Thiol density-dependent classical potential for methyl thiol on a Au(111) surface

J. Kress, Niels Grønbech-Jensen, Byoungseon Jeon, 2007, 0710.0666.

First-Principles Study of Point-Defect Production in Si and SiC

A. Voter, J. Kress, T. Lenosky, 1997 .

CECAM Workshop Scientific Report: Gutzwiller Wave Functions and Related Methods

Jianxin Zhu, Jean-Pierre Julien, Joel D. Kress, 2014 .

Lawson Criterion for Ignition Exceeded In An Inertial Fusion Experiment

J. M. Mack, R. S. Craxton, F. M. Munteanu, 2022, 2022 IEEE International Conference on Plasma Science (ICOPS).

Tight-Binding Molecular Dynamics of Shock Waves in Methane

J. Kress, S. Goedecker, B. Holian, 1999 .

Ab initio molecular dynamics of expanded liquid sodium

J. Kress, D. Hohl, S. Bickham, 1998 .

Quantum molecular dynamics simulations of hot, dense hydrogen.

Kwon, Collins, Kress, 1995, Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics.

Density-functional calculation of the Hugoniot of shocked liquid nitrogen

W. W. Wood, J. Kress, S. Mazevet, 2000 .

Quantum molecular dynamics simulations of dense matter

J. Kress, T. Lenosky, W. Windl, 1998 .

Molecular dynamics simulations of compressed liquid hydrogen

J. Kress, T. Lenosky, L. Collins, 1997 .

Comparison of variational RRKM theory with quantum scattering theory for the Ne+H+2→NeH++H reaction

J. Kress, S. Klippenstein, 1992 .

Reactive ion etching of Si by Cl and Cl2 ions: Molecular dynamics simulations with comparisons to experiment

A. Voter, J. Kress, D. Hanson, 1999 .

Transport properties of lithium hydride at extreme conditions from orbital-free molecular dynamics.

J. Kress, C. Ticknor, L. Collins, 2013, Physical review. E, Statistical, nonlinear, and soft matter physics.

Molecular dynamics simulations of shocked benzene

J. Kress, S. Bickham, L. Collins, 2000 .

Bayesian calibration of thermodynamic models for the uptake of CO2 in supported amine sorbents using ab initio priors.

David C. Miller, Andrew Lee, D. J. Fauth, 2013, Physical chemistry chemical physics : PCCP.

Dynamical and optical properties of warm dense hydrogen

Wolfgang Windl, Joel D. Kress, Lee A. Collins, 2001 .

Controlling Schottky energy barriers in organic electronic devices using self-assembled monolayers.

Smith, Campbell, Kress, 1996, Physical review. B, Condensed matter.

Linear-scaling tight binding from a truncated-moment approach.

Kress, A. Voter, J. Kress, 1996, Physical review. B, Condensed matter.

Bonding and structure in dense multi-component molecular mixtures.

J. Kress, R. Redmer, C. Ticknor, 2015, The Journal of chemical physics.

Thorium-doped CsI: Implications for the thorium nuclear clock transition

J. Kress, S. Rudin, E. Timmermans, 2017, Physical Review A.

Multicomponent mutual diffusion in the warm, dense matter regime

J. Kress, C. Ticknor, A. J. White, 2022, Physics of Plasmas.

Quantum Molecular Dynamics calculations of radiative opacities

J. Kress, S. Mazevet, L. Collins, 2003 .

Enhancement of optical nonlinearity due to breathers in finite polyenes

J. Kress, A. Saxena, A. Bishop, 1998 .

Contributions from the DOE center for semiconductor modeling and simulation

Harold Trease, D. Cartwright, Denise C. George, 1995, Proceedings of the Eleventh Biennial University/Government/ Industry Microelectronics Symposium.

Achievement of Target Gain Larger than Unity in an Inertial Fusion Experiment.

J. M. Mack, F. M. Munteanu, J. R. Rygg, 2024, Physical review letters.