List of works - Salvy P. Russo

2D MoS2 PDMS Nanocomposites for NO2 Separation

scientific article published on 20 July 2015

A kinetic Monte Carlo study of Pt on Au(111) with applications to bimetallic catalysis

scientific article published on 06 December 2010

A molecular dynamics simulation study of LiFePO4/electrolyte interfaces: structure and Li+ transport in carbonate and ionic liquid electrolytes

scientific article published on 27 August 2009

A study of size-dependent properties of MoS2 monolayer nanoflakes using density-functional theory

scientific article published on 29 August 2017

Ab Initio Comparison of Bonding Environments and Threshold Behavior in Ge(x)As10Se(90-x) and Ge(x)Sb10Se(90-x) Glass Models.

scientific article published on 29 May 2015

Ab InitioElectronic Properties of Monolayer Phosphorus Nanowires in Silicon

scientific article published in Physical Review Letters

Ab initio calculation of energy levels for phosphorus donors in silicon

scientific article published on 20 July 2017

Ab initio calculation of valley splitting in monolayer δ-doped phosphorus in silicon

scientific article

Ab initio electronic properties of dual phosphorus monolayers in silicon

scientific article

An ab initio study of structural properties and single vacancy defects in Wurtzite AlN

scientific article published on 01 March 2004

An analysis of the correlation energy contribution to the interaction energy of inert gas dimers

scientific article published on 01 October 2008

Anisotropic intracule densities and electron correlation in H2: a quantum Monte Carlo study

scientific article published on 01 April 2009

Application of the constrained fluid lambda-integration path to the calculation of high temperature Au(110) surface free energies

scientific article published on 01 February 2005

Atomic delocalization as a microscopic origin of two-level defects in Josephson junctions ⬇️

Bilirubin analogues as model compounds for exciton coupling

scientific article published on 02 July 2020

Bonding trends within ternary isocoordinate chalcogenide glasses Ge(x)As(y)Se(1-x-y)

scientific article published on 01 April 2013

Bucky-wires and the instability of diamond (111) surfaces in one-dimension.

scientific article published in January 2004

Characterisation of titanium nitride thin films prepared using PVD and a plasma immersion ion implantation system

scholarly article by S.H.N. Lim et al published May 2002 in Nuclear Instruments & Methods in Physics Research B

Computational modeling of nanorod growth

scientific article published on 01 November 2007

Correlating the Energetics and Atomic Motions of the Metal-Insulator Transition of M1 Vanadium Dioxide. ⬇️

scientific article published on 23 May 2016

Corrigendum: Wafer-scale two-dimensional semiconductors from printed oxide skin of liquid metals.

scientific article published on 22 March 2017

Delocalized Oxygen as the Origin of Two-Level Defects in Josephson Junctions

scientific article published in Physical Review Letters

Different solvates of the dinuclear cyclometallated gold(I) complex [Au2(μ-2-C6H4AsMe2)2]: a computational study insight into solvent-effected optical properties.

scientific article published on 4 June 2013

Effect of nitrogen and intrinsic defect complexes on conversion efficiency of ZnO for hydrogen generation from water

scientific article published on 03 August 2011

Electron-nucleus cusp correction and forces in quantum Monte Carlo

scientific article published on 01 March 2008

Energetic degeneracy and electronic structures of germanium trimers doped with titanium

scientific article published on 01 August 2020

Enhanced Charge Carrier Mobility in Two-Dimensional High Dielectric Molybdenum Oxide

article

Exciton Dynamics of a Diketo-Pyrrolopyrrole Core for All Low-Lying Electronic Excited States Using Density Functional Theory-Based Methods

scientific article published on 24 February 2022

First-Principles Modeling of Dopants in C29and C29H24Nanodiamonds

scientific article published on 01 June 2005

Gas sensing properties of p-type semiconducting Cr-doped TiO2 thin films

How Important is Orbital Choice in Single-Determinant Diffusion Quantum Monte Carlo Calculations?

scientific article published on 26 June 2012

Hubbard physics in the PAW GW approximation ⬇️

scientific article published on 01 June 2016

Influence of substrate morphology on the growth of gold nanoparticles

scientific article published on 01 October 2008

Liquid-Metal-Templated Synthesis of 2D Graphitic Materials at Room Temperature

scientific article published on 08 June 2020

Long-time behavior of the velocity autocorrelation function for moderately dense, soft-repulsive, and Lennard-Jones fluids

scientific article published on 23 January 2001

Modeling the crystallization of gold nanoclusters-the effect of the potential energy function

scientific article published on 18 March 2009

Modeling the environmental stability of FeS2 nanorods, using lessons from biomineralization

scientific article published on 25 February 2009

Morphological and phase stability of zinc blende, amorphous and mixed core–shell ZnS nanoparticles

scientific article published on 02 September 2010

On fitting a gold embedded atom method potential using the force matching method

scientific article published on 01 November 2005

On morphologies of gold nanoparticles grown from molecular dynamics simulation

scientific article published on 01 April 2007

On reverse Monte Carlo constraints and model reproduction

scientific article published on 10 April 2017

On the computational calculation of surface free energies for the disordered semihexagonal reconstructed Au(100) surface

scientific article published on 01 May 2005

On the formation mechanism of the "pancake" decahedron gold nanoparticle

scientific article published on 01 December 2007

On the relative stabilities of gold nanoparticles

scientific article published on 01 December 2007

Optical properties of a conjugated-polymer-sensitised solar cell: the effect of interfacial structure

scientific article published on 13 April 2015

Physisorption-Based Charge Transfer in Two-Dimensional SnS2 for Selective and Reversible NO2 Gas Sensing

scientific article published on 8 October 2015

Polycrystalline and amorphous sol-gel derived WO/sub 3/ thin films and their gas sensing properties

Predicting large area surface reconstructions using molecular dynamics methods

scientific article published on 01 February 2014

Printing two-dimensional gallium phosphate out of liquid metal

scientific article published in Nature Communications

PyPhotonics: A python package for the evaluation of luminescence properties of defects

scientific article published in 2022

Quantum Monte Carlo calculations of the potential energy curve of the helium dimer

scientific article published on 01 March 2008

Quasi physisorptive two dimensional tungsten oxide nanosheets with extraordinary sensitivity and selectivity to NO2.

scientific article published on 29 November 2017

Simulating nano-carbon materials

article

Simulation and bonding of dopants in nanocrystalline diamond.

scientific article

Size- and shape-dependent phase transformations in wurtzite ZnS nanostructures

scientific article published on 22 June 2012

Structural modeling of Ge6.25As32.5Se61.25 using a combination of reverse Monte Carlo and Ab initio molecular dynamics

scientific article published on 19 June 2014

Substoichiometric two-dimensional molybdenum oxide flakes: a plasmonic gas sensing platform

scientific article published on November 2014

Surface-gate-defined single-electron transistor in a MoS2 bilayer ⬇️

scientific article published on 21 February 2017

Synthesis and structures of cyclic gold complexes containing diphosphine ligands and luminescent properties of the high nuclearity species.

scientific article published on 2 March 2012

Topological characterization of crystallization of gold nanoclusters

scientific article published on 01 September 2006

Tunable Plasmon Resonances in Two-Dimensional Molybdenum Oxide Nanoflakes

scientific article published on 26 March 2014

Ultrafast Acoustofluidic Exfoliation of Stratified Crystals

scientific article published on 30 March 2018

Vacancy induced formation of nanoporous silicon, carbon and silicon carbide

scientific article published in 2019

Wafer-Scale Synthesis of Semiconducting SnO Monolayers from Interfacial Oxide Layers of Metallic Liquid Tin.

scientific article

Wafer-Sized Ultrathin Gallium and Indium Nitride Nanosheets through the Ammonolysis of Liquid Metal Derived Oxides

scientific article published on 24 December 2018

Wafer-scale two-dimensional semiconductors from printed oxide skin of liquid metals.

scientific article published on 17 February 2017

Zero-variance zero-bias quantum Monte Carlo estimators for the electron density at a nucleus.

scientific article

“Exact” surface free energies of iron surfaces using a modified embedded atom method potential and λ integration

scientific article published on 01 February 2004

List of works by Salvy P. Russo

2D MoS2 PDMS Nanocomposites for NO2 Separation

A kinetic Monte Carlo study of Pt on Au(111) with applications to bimetallic catalysis

A molecular dynamics simulation study of LiFePO4/electrolyte interfaces: structure and Li+ transport in carbonate and ionic liquid electrolytes

A study of size-dependent properties of MoS2 monolayer nanoflakes using density-functional theory

Ab Initio Comparison of Bonding Environments and Threshold Behavior in Ge(x)As10Se(90-x) and Ge(x)Sb10Se(90-x) Glass Models.

Ab InitioElectronic Properties of Monolayer Phosphorus Nanowires in Silicon

Ab initio calculation of energy levels for phosphorus donors in silicon

Ab initio calculation of valley splitting in monolayer δ-doped phosphorus in silicon

Ab initio electronic properties of dual phosphorus monolayers in silicon

An ab initio study of structural properties and single vacancy defects in Wurtzite AlN

An analysis of the correlation energy contribution to the interaction energy of inert gas dimers

Anisotropic intracule densities and electron correlation in H2: a quantum Monte Carlo study

Application of the constrained fluid lambda-integration path to the calculation of high temperature Au(110) surface free energies

Atomic delocalization as a microscopic origin of two-level defects in Josephson junctions ⬇️

Bilirubin analogues as model compounds for exciton coupling

Bonding trends within ternary isocoordinate chalcogenide glasses Ge(x)As(y)Se(1-x-y)

Bucky-wires and the instability of diamond (111) surfaces in one-dimension.

Characterisation of titanium nitride thin films prepared using PVD and a plasma immersion ion implantation system

Computational modeling of nanorod growth

Correlating the Energetics and Atomic Motions of the Metal-Insulator Transition of M1 Vanadium Dioxide. ⬇️

Corrigendum: Wafer-scale two-dimensional semiconductors from printed oxide skin of liquid metals.

Delocalized Oxygen as the Origin of Two-Level Defects in Josephson Junctions

Different solvates of the dinuclear cyclometallated gold(I) complex [Au2(μ-2-C6H4AsMe2)2]: a computational study insight into solvent-effected optical properties.

Effect of nitrogen and intrinsic defect complexes on conversion efficiency of ZnO for hydrogen generation from water

Electron-nucleus cusp correction and forces in quantum Monte Carlo

Energetic degeneracy and electronic structures of germanium trimers doped with titanium

Enhanced Charge Carrier Mobility in Two-Dimensional High Dielectric Molybdenum Oxide

Exciton Dynamics of a Diketo-Pyrrolopyrrole Core for All Low-Lying Electronic Excited States Using Density Functional Theory-Based Methods

First-Principles Modeling of Dopants in C29and C29H24Nanodiamonds

Gas sensing properties of p-type semiconducting Cr-doped TiO2 thin films

How Important is Orbital Choice in Single-Determinant Diffusion Quantum Monte Carlo Calculations?

Hubbard physics in the PAW GW approximation ⬇️

Influence of substrate morphology on the growth of gold nanoparticles

Liquid-Metal-Templated Synthesis of 2D Graphitic Materials at Room Temperature

Long-time behavior of the velocity autocorrelation function for moderately dense, soft-repulsive, and Lennard-Jones fluids

Modeling the crystallization of gold nanoclusters-the effect of the potential energy function

Modeling the environmental stability of FeS2 nanorods, using lessons from biomineralization

Morphological and phase stability of zinc blende, amorphous and mixed core–shell ZnS nanoparticles

On fitting a gold embedded atom method potential using the force matching method

On morphologies of gold nanoparticles grown from molecular dynamics simulation

On reverse Monte Carlo constraints and model reproduction

On the computational calculation of surface free energies for the disordered semihexagonal reconstructed Au(100) surface

On the formation mechanism of the "pancake" decahedron gold nanoparticle

On the relative stabilities of gold nanoparticles

Optical properties of a conjugated-polymer-sensitised solar cell: the effect of interfacial structure

Physisorption-Based Charge Transfer in Two-Dimensional SnS2 for Selective and Reversible NO2 Gas Sensing

Polycrystalline and amorphous sol-gel derived WO/sub 3/ thin films and their gas sensing properties

Predicting large area surface reconstructions using molecular dynamics methods

Printing two-dimensional gallium phosphate out of liquid metal

PyPhotonics: A python package for the evaluation of luminescence properties of defects

Quantum Monte Carlo calculations of the potential energy curve of the helium dimer

Quasi physisorptive two dimensional tungsten oxide nanosheets with extraordinary sensitivity and selectivity to NO2.

Simulating nano-carbon materials

Simulation and bonding of dopants in nanocrystalline diamond.

Size- and shape-dependent phase transformations in wurtzite ZnS nanostructures

Structural modeling of Ge6.25As32.5Se61.25 using a combination of reverse Monte Carlo and Ab initio molecular dynamics

Substoichiometric two-dimensional molybdenum oxide flakes: a plasmonic gas sensing platform

Surface-gate-defined single-electron transistor in a MoS2 bilayer ⬇️

Synthesis and structures of cyclic gold complexes containing diphosphine ligands and luminescent properties of the high nuclearity species.

Topological characterization of crystallization of gold nanoclusters

Tunable Plasmon Resonances in Two-Dimensional Molybdenum Oxide Nanoflakes

Ultrafast Acoustofluidic Exfoliation of Stratified Crystals

Vacancy induced formation of nanoporous silicon, carbon and silicon carbide

Wafer-Scale Synthesis of Semiconducting SnO Monolayers from Interfacial Oxide Layers of Metallic Liquid Tin.

Wafer-Sized Ultrathin Gallium and Indium Nitride Nanosheets through the Ammonolysis of Liquid Metal Derived Oxides

Wafer-scale two-dimensional semiconductors from printed oxide skin of liquid metals.

Zero-variance zero-bias quantum Monte Carlo estimators for the electron density at a nucleus.

“Exact” surface free energies of iron surfaces using a modified embedded atom method potential and λ integration