Zobrazeno 1 - 8
of 8
pro vyhledávání: '"Joyce T. Lopes"'
Publikováno v:
Journal of Chemical & Engineering Data. 65:5735-5742
Hydrogen is a promising component for a more sustainable world, but its wide application depends upon the development of new technologies and processes. Therefore, a reliable set of thermodynamic p...
Autor:
Luís F.M. Franco, Joyce T. Lopes
Publikováno v:
Industrial & Engineering Chemistry Research. 58:6850-6859
We propose a new thermodynamic approach for nonspherical molecules by applying a perturbation theory in which an anisotropic intermolecular potential, the hard Gaussian overlap, is the reference system. The new equation of state (EoS) modifies the us
Publikováno v:
Process Safety and Environmental Protection. 113:88-96
Storage and transportation in carbon capture and sequestration (CCS) technology involve dealing with CO2 at high pressures, which can lead to accidental releases. To assess and control risks and to calculate the minimum safe distance from tanks and p
Publikováno v:
Fluid Phase Equilibria. 549:113209
Perturbation theory has been the center of the development of the new generation of equations of state. First- and second-order perturbation theories are very common, but require approximations for obtaining an analytical form. Recently, a new equati
Autor:
Luís F.M. Franco, Joyce T. Lopes
Publikováno v:
Journal of Molecular Liquids. 330:115676
Different molecular geometries are determinant to condensed phases structures, and to the thermodynamic behavior. To take into consideration the nonsphericity in the development of equations of state, molecules have been taken either as chains of sph
Publikováno v:
Journal of Chemical Physics
Journal of Chemical Physics, American Institute of Physics, 2021, 154 (10), pp.104902. ⟨10.1063/5.0040942⟩
Journal of Chemical Physics, American Institute of Physics, 2021, 154 (10), pp.104902. ⟨10.1063/5.0040942⟩
Using isobaric Monte Carlo simulations, we map out the entire phase diagram of a system of hard cylindrical particles of length $L$ and diameter $D$, using an improved algorithm to identify the overlap condition between two cylinders. Both the prolat
Autor:
Luís F.M. Franco, Joyce T. Lopes
Publikováno v:
Fluid Phase Equilibria. 506:112380
Prediction of derivative properties, such as the isochoric heat capacity, remains a real challenge for equations of state. Molecular-based equations of state are derived through a set of approximations, e. g., perturbation theory. The subtleness of t
Publikováno v:
Blucher Chemical Engineering Proceedings.