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LEVEL: A computer program for solving the radial Schrödinger equation for bound and quasibound levels

Journal of quantitative spectroscopy & radiative transfer, 2017-01, Vol.186, p.167-178

Le Roy, Robert J.

2017

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Equation of state and first principles prediction of the vibrational matrix shift of solid parahydrogen

The Journal of chemical physics, 2019-12, Vol.151 (24), p.244501-244501

2019

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Long-term creep properties of cementitious materials: Comparing microindentation testing with macroscopic uniaxial compressive testing

Cement and concrete research, 2014, Vol.58, p.89-98

2014

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An accurate analytic potential function for ground-state N2 from a direct-potential-fit analysis of spectroscopic data

The Journal of chemical physics, 2006-10, Vol.125 (16), p.164310-164310

2006

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Method to analyse the contribution of material's sensitivity in buildings' environmental impact

Journal of cleaner production, 2014-03, Vol.66, p.54-64

2014

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betaFIT: A computer program to fit pointwise potentials to selected analytic functions

Journal of quantitative spectroscopy & radiative transfer, 2017-01, Vol.186, p.210-220

2017

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Full empirical potential curves for the X(1)Σ(+) and A(1)Π states of CH(+) from a direct-potential-fit analysis

The Journal of chemical physics, 2016-01, Vol.144 (2), p.024311-024311

2016

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Photofunctionalization of dental zirconia oxide: Surface modification to improve bio-integration preserving crystal stability

Colloids and surfaces, B, Biointerfaces, 2017-08, Vol.156, p.194-202

2017

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RKR1: A computer program implementing the first-order RKR method for determining diatomic molecule potential energy functions

Journal of quantitative spectroscopy & radiative transfer, 2017-01, Vol.186, p.158-166

Le Roy, Robert J.

2017

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Reducing environmental impact by increasing the strength of concrete: quantification of the improvement to concrete bridges

Journal of cleaner production, 2012, Vol.35, p.250-262

2012

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Influence of bacterial cellulose stabilization on strength characteristics of construction earthen materials

Materials and structures, 2024-06, Vol.57 (5), Article 118

2024

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Constructing high-accuracy intermolecular potential energy surface with multi-dimension Morse/Long-Range model

Molecular physics, 2018-04, Vol.116 (7-8), p.843-853

2018

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A new six-dimensional potential energy surface for H2-N2O and its adiabatic-hindered-rotor treatment

The Journal of chemical physics, 2013-07, Vol.139 (3), p.034312-034312

2013

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Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO2-H2

The Journal of chemical physics, 2010-06, Vol.132 (21), p.214309-214309

2010

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"Adiabatic-hindered-rotor" treatment of the parahydrogen-water complex

The Journal of chemical physics, 2011-09, Vol.135 (9), p.094304-094304-15

2011

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First-principles prediction of the Raman shifts in parahydrogen clusters

The Journal of chemical physics, 2014-07, Vol.141 (1), p.014310-014310

2014

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Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO-H2 dimer and frequency shifts of CO in (para-H2)N N = 1-20 clusters

The Journal of chemical physics, 2013-10, Vol.139 (16), p.164315-164315

2013

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Yield stress measurement for earth-based building materials: the weighted plunger test

Materials and structures, 2021, Vol.54 (1), Article 6

2021

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Dissociation energies and potential energy functions for the ground X (1)Σ(+) and "avoided-crossing" A (1)Σ(+) states of NaH

The Journal of chemical physics, 2015-01, Vol.142 (4), p.044305-044305

2015

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Long-range damping functions improve the short-range behaviour of 'MLR' potential energy functions

Molecular physics, 2011-02, Vol.109 (3), p.435-446

2011

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A new potential function form incorporating extended long-range behaviour: application to ground-state Ca 2

Molecular physics, 2007-03, Vol.105 (5-7), p.663-677

2007

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The Marsh cone: a test or a rheological apparatus?

Cement and concrete research, 2005-05, Vol.35 (5), p.823-830

2005

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Raman Vibrational Shifts of Small Clusters of Hydrogen Isotopologues

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-12, Vol.119 (50), p.12551-12561

2015

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Accurate Analytic Potential and Born–Oppenheimer Breakdown Functions for MgH and MgD from a Direct-Potential-Fit Data Analysis

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-12, Vol.117 (50), p.13373-13387

2013

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A new potential function form incorporating extended long-range behaviour: application to ground-state Ca2

Molecular physics, 2007-03, Vol.105 (5-7), p.663-677

2007

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LEVEL: A computer program for solving the radial Schrödinger equation for bound and quasibound levels

Equation of state and first principles prediction of the vibrational matrix shift of solid parahydrogen

Long-term creep properties of cementitious materials: Comparing microindentation testing with macroscopic uniaxial compressive testing

An accurate analytic potential function for ground-state N2 from a direct-potential-fit analysis of spectroscopic data

Method to analyse the contribution of material's sensitivity in buildings' environmental impact

betaFIT: A computer program to fit pointwise potentials to selected analytic functions

Full empirical potential curves for the X(1)Σ(+) and A(1)Π states of CH(+) from a direct-potential-fit analysis

Photofunctionalization of dental zirconia oxide: Surface modification to improve bio-integration preserving crystal stability

RKR1: A computer program implementing the first-order RKR method for determining diatomic molecule potential energy functions

Reducing environmental impact by increasing the strength of concrete: quantification of the improvement to concrete bridges

Influence of bacterial cellulose stabilization on strength characteristics of construction earthen materials

Constructing high-accuracy intermolecular potential energy surface with multi-dimension Morse/Long-Range model

A new six-dimensional potential energy surface for H2-N2O and its adiabatic-hindered-rotor treatment

Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO2-H2

"Adiabatic-hindered-rotor" treatment of the parahydrogen-water complex

First-principles prediction of the Raman shifts in parahydrogen clusters

Analytic Morse/long-range potential energy surfaces and predicted infrared spectra for CO-H2 dimer and frequency shifts of CO in (para-H2)N N = 1-20 clusters

Yield stress measurement for earth-based building materials: the weighted plunger test

Dissociation energies and potential energy functions for the ground X (1)Σ(+) and "avoided-crossing" A (1)Σ(+) states of NaH

Long-range damping functions improve the short-range behaviour of 'MLR' potential energy functions

A new potential function form incorporating extended long-range behaviour: application to ground-state Ca 2

The Marsh cone: a test or a rheological apparatus?

Raman Vibrational Shifts of Small Clusters of Hydrogen Isotopologues

Accurate Analytic Potential and Born–Oppenheimer Breakdown Functions for MgH and MgD from a Direct-Potential-Fit Data Analysis

A new potential function form incorporating extended long-range behaviour: application to ground-state Ca2

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