Smooth relativistic Hartree-Fock pseudopotentials for H to Ba and Lu to Hg
We report smooth relativistic Hartree-Fock pseudopotentials (also known as averaged relativistic effective potentials or AREPs) and spin-orbit operators for the atoms H to Ba and Lu to Hg.
Fischer C. Froese +2 more
core +1 more source
Development of a Multiphase Photon Monte Carlo Method for Spray Combustion and its Application in High-pressure Conditions [PDF]
In this work the development of a multiphase photon Monte Carlo (PMC) method with a focus on resolving radiative heat transfer in combustion simulations is presented.
Cai, Jian +2 more
core +2 more sources
Adaptation of n-heptane autoignition tabulation for complex chemistry mechanisms
The adaptation of auto-ignition tabulation for effective use of complex chemical mechanisms will be presented in this paper. Taking cool flame ignition phenomenon into account could improve numerical simulations of combustion in compression ignition engines.
Ban, Marko, Duić, Neven
openaire +2 more sources
Evaporative cooling effects and turbulence flame interaction are analyzed in the large eddy simulation (LES) context for an ethanol turbulent spray flame.
Fernando Luiz Sacomano Filho +4 more
doaj +1 more source
Herschel/HIFI observations of interstellar OH+ and H2O+ towards W49N: a probe of diffuse clouds with a small molecular fraction [PDF]
We report the detection of absorption by interstellar hydroxyl cations and water cations, along the sight-line to the bright continuum source W49N.
A. Coutens +75 more
core +2 more sources
The Saturated and Supercritical Stirling Cycle Thermodynamic Heat Engine Cycle
On the assumption that experimentally validated tabulated thermodynamic properties of saturated fluids published by the National Institute of Standards and Technology are accurate, a theoretical thermodynamic cycle can be demonstrated that produces a net-
Marko, Matthew David
core +1 more source
Multifrequency radiation hydrodynamics simulations of H2 line emission in primordial, star-forming clouds [PDF]
We investigate the collapse of primordial gas in a minihalo with three-dimensional radiation hydrodynamics simulations that accurately model the transfer of H2 line emission.
Greif, Thomas H.
core +1 more source
Atomic and Molecular Opacities for Brown Dwarf and Giant Planet Atmospheres [PDF]
We present a comprehensive description of the theory and practice of opacity calculations from the infrared to the ultraviolet needed to generate models of the atmospheres of brown dwarfs and extrasolar giant planets.
A. Burrows +26 more
core +3 more sources
Mapping the evolution of mitochondrial complex I through structural variation
Respiratory complex I (CI) is crucial for bioenergetic metabolism in many prokaryotes and eukaryotes. It is composed of a conserved set of core subunits and additional accessory subunits that vary depending on the organism. Here, we categorize CI subunits from available structures to map the evolution of CI across eukaryotes. Respiratory complex I (CI)
Dong‐Woo Shin +2 more
wiley +1 more source
The potential of a progress variable formulation for predicting autoignition and subsequent kernel development in a nonpremixed jet flame is explored in the LES (Large Eddy Simulation) context. The chemistry is tabulated as a function of mixture fraction
Rohit Kulkarni, Wolfgang Polifke
doaj +1 more source

