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Application of the modified Shepard interpolation method to the determination of the potential energy surface for a molecule-surface reaction: H2 + Pt(111)

The Journal of chemical physics, 2004-02, Vol.120 (5), p.2392-2404

2004

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Toward a Specific Reaction Parameter Density Functional for H2 + Ni(111): Comparison of Theory with Molecular Beam Sticking Experiments

Journal of physical chemistry. C, 2019-08, Vol.123 (33), p.20420-20433

2019

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Diffractive and reactive scattering of H2 from Ru(0001): experimental and theoretical study

Physical chemistry chemical physics : PCCP, 2011-01, Vol.13 (18), p.8583-8597

2011

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The photodissociation of the water dimer in the A ̃ band:A twelve-dimensional quasiclassical study

The Journal of chemical physics, 2008-04, Vol.128 (14), p.144313-144313-21

2008

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Sticking of CO to crystalline and amorphous ice surfaces

The Journal of chemical physics, 2004-02, Vol.120 (7), p.3358-3367

2004

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Molecular surface structure of ice(0001): dynamical low-energy electron diffraction, total-energy calculations and molecular dynamics simulations

Surface science, 1997-06, Vol.381 (2), p.190-210

1997

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Dissociative chemisorption of H2 on Pt(111): isotope effect and effects of the rotational distribution and energy dispersion

Surface science, 2004-12, Vol.573 (3), p.433-445

2004

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Reactive scattering of H2 from Cu(100): comparison of dynamics calculations based on the specific reaction parameter approach to density functional theory with experiment

The Journal of chemical physics, 2013-01, Vol.138 (4), p.044708-044708

2013

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Six-dimensional dynamics study of reactive and non reactive scattering of H2 from Cu(111) using a chemically accurate potential energy surface

Physical chemistry chemical physics : PCCP, 2010, Vol.12 (24), p.6499-6519

2010

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Exploring surface landscapes with molecules: rotationally induced diffraction of H 2 on LiF(001) under fast grazing incidence conditions

Physical chemistry chemical physics : PCCP, 2017-07, Vol.19 (25), p.16317-16322

2017

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Chemically Accurate Simulation of a Prototypical Surface Reaction: H₂ Dissociation on Cu(111)

Science (American Association for the Advancement of Science), 2009-11, Vol.326 (5954), p.832-834

2009

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Sticking of Hydrogen Atoms to Crystalline Ice Surfaces: Dependence on Incidence Energy and Surface Temperature

The journal of physical chemistry. B, 2002-06, Vol.106 (25), p.6515-6522

2002

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Towards a specific reaction parameter density functional for reactive scattering of H2 from Pd(111)

The Journal of chemical physics, 2013-12, Vol.139 (24), p.244707-244707

2013

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Real time chemical dynamics at surfaces

Surface science, 2002-03, Vol.500 (1-3), p.475-499

2002

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Multidimensional effects on dissociation of N2 on Ru(0001)

Physical review letters, 2006-03, Vol.96 (9), p.096102-096102

2006

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Dissociative chemisorption of H2 on the Cu(110) surface: a quantum and quasiclassical dynamical study

The Journal of chemical physics, 2007-10, Vol.127 (16), p.164722-164722

2007

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An analytical six-dimensional potential energy surface for dissociation of molecular hydrogen on Cu(100)

The Journal of chemical physics, 1996-05, Vol.104 (18), p.7344-7358

1996

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Sticking of Hyperthermal CO to the (0001) Face of Crystalline Ice

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2003-12, Vol.107 (49), p.10615-10624

2003

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Reactive and diffractive scattering of H2 from Pt(111) studied using a six-dimensional wave packet method

The Journal of chemical physics, 2002-09, Vol.117 (12), p.5885-5898

2002

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Assessing Options to Increase Water Productivity in Irrigated River Basins Using Remote Sensing and Modelling Tools

International journal of water resources development, 2006-03, Vol.22 (1), p.115-133

2006

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Propagation of Uncertainties in Soil and Pesticide Properties to Pesticide Leaching

Journal of environmental quality, 2012-01, Vol.41 (1), p.253-261

2012

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H 2 / LiF ( 001 ) diffractive scattering under fast grazing incidence using a DFT-based potential energy surface

Physical review. B, 2017-11, Vol.96 (20), Article 205432

2017

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Reactive and nonreactive scattering of N2 from Ru(0001): a six-dimensional adiabatic study

The Journal of chemical physics, 2006-09, Vol.125 (11), p.114706-114706

2006

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Rotational effects in dissociation of H2 on Pd(111): Quantum and classical study

The Journal of chemical physics, 2003-12, Vol.119 (23), p.12553-12562

2003

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Vibrational deexcitation and rotational excitation of H2 and D2 scattered from Cu(111): adiabatic versus non-adiabatic dynamics

The Journal of chemical physics, 2012-08, Vol.137 (6), p.064707-064707

2012

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Application of the modified Shepard interpolation method to the determination of the potential energy surface for a molecule-surface reaction: H2 + Pt(111)

Toward a Specific Reaction Parameter Density Functional for H2 + Ni(111): Comparison of Theory with Molecular Beam Sticking Experiments

Diffractive and reactive scattering of H2 from Ru(0001): experimental and theoretical study

The photodissociation of the water dimer in the A ̃ band:A twelve-dimensional quasiclassical study

Sticking of CO to crystalline and amorphous ice surfaces

Molecular surface structure of ice(0001): dynamical low-energy electron diffraction, total-energy calculations and molecular dynamics simulations

Dissociative chemisorption of H2 on Pt(111): isotope effect and effects of the rotational distribution and energy dispersion

Reactive scattering of H2 from Cu(100): comparison of dynamics calculations based on the specific reaction parameter approach to density functional theory with experiment

Six-dimensional dynamics study of reactive and non reactive scattering of H2 from Cu(111) using a chemically accurate potential energy surface

Exploring surface landscapes with molecules: rotationally induced diffraction of H 2 on LiF(001) under fast grazing incidence conditions

Chemically Accurate Simulation of a Prototypical Surface Reaction: H₂ Dissociation on Cu(111)

Sticking of Hydrogen Atoms to Crystalline Ice Surfaces: Dependence on Incidence Energy and Surface Temperature

Towards a specific reaction parameter density functional for reactive scattering of H2 from Pd(111)

Real time chemical dynamics at surfaces

Multidimensional effects on dissociation of N2 on Ru(0001)

Dissociative chemisorption of H2 on the Cu(110) surface: a quantum and quasiclassical dynamical study

An analytical six-dimensional potential energy surface for dissociation of molecular hydrogen on Cu(100)

Sticking of Hyperthermal CO to the (0001) Face of Crystalline Ice

Reactive and diffractive scattering of H2 from Pt(111) studied using a six-dimensional wave packet method

Assessing Options to Increase Water Productivity in Irrigated River Basins Using Remote Sensing and Modelling Tools

Propagation of Uncertainties in Soil and Pesticide Properties to Pesticide Leaching

H 2 / LiF ( 001 ) diffractive scattering under fast grazing incidence using a DFT-based potential energy surface

Reactive and nonreactive scattering of N2 from Ru(0001): a six-dimensional adiabatic study

Rotational effects in dissociation of H2 on Pd(111): Quantum and classical study

Vibrational deexcitation and rotational excitation of H2 and D2 scattered from Cu(111): adiabatic versus non-adiabatic dynamics

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