Thermophysical properties of the Lennard-Jones fluid: Database and data assessment
Literature data on the thermophysical properties of the Lennard-Jones fluid, which were
sampled with molecular dynamics and Monte Carlo simulations, were reviewed and …
sampled with molecular dynamics and Monte Carlo simulations, were reviewed and …
Review and comparison of equations of state for the Lennard-Jones fluid
Abstract The Lennard-Jones (LJ) potential is widely used for describing simple fluids; it is
also a point of departure for developing models of complex fluids. Thermodynamic …
also a point of departure for developing models of complex fluids. Thermodynamic …
The effect of pulse duration on nanoparticle generation in pulsed laser ablation in liquids: insights from large-scale atomistic simulations
The generation of colloidal solutions of chemically clean nanoparticles through pulsed laser
ablation in liquids (PLAL) has evolved into a thriving research field that impacts industrial …
ablation in liquids (PLAL) has evolved into a thriving research field that impacts industrial …
[HTML][HTML] On the history of key empirical intermolecular potentials
J Fischer, M Wendland - Fluid Phase Equilibria, 2023 - Elsevier
Intermolecular potentials are considered which were suggested between 1903 and 1971.
These comprise the Mie potentials, the Lennard-Jones potentials, the Kihara potential, the …
These comprise the Mie potentials, the Lennard-Jones potentials, the Kihara potential, the …
Atomistic modeling of nanoparticle generation in short pulse laser ablation of thin metal films in water
Laser ablation in liquids is actively used for generation of clean colloidal nanoparticles with
unique shapes and functionalities. The fundamental mechanisms of the laser ablation in …
unique shapes and functionalities. The fundamental mechanisms of the laser ablation in …
[HTML][HTML] Phase diagram and universality of the Lennard-Jones gas-liquid system
The gas-liquid phase transition of the three-dimensional Lennard-Jones particles system is
studied by molecular dynamics simulations. The gas and liquid densities in the coexisting …
studied by molecular dynamics simulations. The gas and liquid densities in the coexisting …
Atomistic modeling of pulsed laser ablation in liquid: spatially and time-resolved maps of transient nonequilibrium states and channels of nanoparticle formation
C Chen, LV Zhigilei - Applied Physics A, 2023 - Springer
The mechanisms of picosecond pulse laser ablation in liquid are investigated in a series of
large-scale atomistic simulations performed for FeNi targets irradiated in a liquid …
large-scale atomistic simulations performed for FeNi targets irradiated in a liquid …
Nonequilibrium molecular dynamics simulations of a bubble
Molecular dynamics simulations are performed to investigate the microscopic dynamics of a
bubble when liquids are locally heated. We successfully observe that the heated atoms …
bubble when liquids are locally heated. We successfully observe that the heated atoms …
Multibaric–multithermal ensemble molecular dynamics simulations
We present new generalized‐ensemble molecular dynamics simulation algorithms, which
we refer to as the multibaric–multithermal molecular dynamics. We describe three algorithms …
we refer to as the multibaric–multithermal molecular dynamics. We describe three algorithms …
Molecular dynamics simulations in the multibaric–multithermal ensemble
We propose a new generalized-ensemble molecular dynamics simulation algorithm, which
we refer to as the multibaric–multithermal molecular dynamics. This is the molecular …
we refer to as the multibaric–multithermal molecular dynamics. This is the molecular …