Thermodynamic model and high-temperature Raman spectra of 25Na2O·75B2O3 glassforming melts
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Thermal Analysis and Calorimetry"
DOI: 10.1007/s10973-017-6703-8
Abstract: AbstractThe temperature dependence of Raman spectra of 25Na2O·75B2O3 melts recorded in the temperature range 321–1142 °C was studied by statistical methods (principal component analysis, PCA, and multivariate curve resolution, MCR) and by the thermodynamic model of… read more here.
Keywords: raman; temperature; spectra 25na2o; thermodynamic model ... See more keywords
Drug-Polymer Solubility Determination: A New Thermodynamic Model Free from Lattice Theory Assumptions
Sign Up to like & getrecommendations! Published in 2019 at "Pharmaceutical Research"
DOI: 10.1007/s11095-019-2710-8
Abstract: Traditional methods for estimating drug-polymer solubility either require fast dissolution in the polymeric matrix, rapid re-crystallization kinetics from supersaturated states or derive from regular solution theories. In this work, we present a new method for… read more here.
Keywords: polymer solubility; drug polymer; drug; solubility ... See more keywords
Temperature dependent Grüneisen parameter
Sign Up to like & getrecommendations! Published in 2019 at "Science China Technological Sciences"
DOI: 10.1007/s11431-019-9526-3
Abstract: Gruneisen parameter is one of the most valuable quantities in thermodynamics, which links the material properties of bulk modulus, heat capacity at constant volume, thermal expansion coefficient, and volume together. A new thermodynamic model of… read more here.
Keywords: temperature; temperature dependent; gruneisen parameter; thermodynamic model ... See more keywords
Direct adjustment of wax thermodynamic model parameter to micro Differential Scanning Calorimetry thermograms
Sign Up to like & getrecommendations! Published in 2017 at "Fluid Phase Equilibria"
DOI: 10.1016/j.fluid.2016.12.022
Abstract: Abstract Among the flow assurance subjects, wax deposition plays a major role. As exploration an oil production moves towards deeper water frontiers, longer tiebacks increase the risk of wax deposition, which is assessed through modeling.… read more here.
Keywords: wax; adjustment wax; model; thermodynamic model ... See more keywords
A novel fitted thermodynamic model for the capture of CO2 from flue gas by the hydrate method
Sign Up to like & getrecommendations! Published in 2019 at "Natural Gas Industry B"
DOI: 10.1016/j.ngib.2019.04.006
Abstract: Abstract The hydrate-based gas separation for capturing CO2 from flue gas has the characteristics of low energy consumption, simple operation and convenience for the subsequent CO2 storage and utilization. In order to reduce the total… read more here.
Keywords: co2 flue; flue gas; gas; model ... See more keywords
Structural and Thermodynamic Model for the Activation of Cardiac Troponin.
Sign Up to like & getrecommendations! Published in 2022 at "Biochemistry"
DOI: 10.1021/acs.biochem.2c00084
Abstract: Cardiac troponin is a regulatory protein complex located on the sarcomere that regulates the engagement of myosin on actin filaments. Low-molecular weight modulators of troponin that bind allosterically with the calcium ion have the potential… read more here.
Keywords: thermodynamic model; activation cardiac; structural thermodynamic; troponin ... See more keywords
Unified Thermodynamic Model for Performance Prediction of Adiabatic Feedstock Gasifiers
Sign Up to like & getrecommendations! Published in 2020 at "Industrial & Engineering Chemistry Research"
DOI: 10.1021/acs.iecr.0c03703
Abstract: A unified thermodynamic modeling approach for feedstock gasification under adiabatic conditions at the carbon boundary point (CBP) using O2, steam, or/and CO2 as gasification agents is proposed by ... read more here.
Keywords: prediction adiabatic; unified thermodynamic; feedstock; model performance ... See more keywords
A Temperature-Dependent Thermodynamic Model Derived from Heat Capacity of Metal Chloride Aqueous Solutions
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Chemical & Engineering Data"
DOI: 10.1021/acs.jced.7b00483
Abstract: In this work, a temperature-dependent thermodynamic model based on heat capacity was proposed to predict the osmotic and mean ion activity coefficients of metal chloride aqueous solutions. The CaCl2–H2O system was used to verify the… read more here.
Keywords: dependent thermodynamic; model; temperature dependent; thermodynamic model ... See more keywords
Ab Initio Thermodynamics of Surface Oxide Structures under Controlled Growth Conditions
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Physical Chemistry C"
DOI: 10.1021/acs.jpcc.6b11445
Abstract: Having a robust and predictive ab initio thermodynamic model to examine and describe the interplay of the oxygen gas and evaporated metal atoms on another metal substrate may prove to be very helpful in understanding… read more here.
Keywords: growth conditions; oxide structures; thermodynamics; metal ... See more keywords
A revised thermodynamic model for crystal surfaces. I. Theoretical aspects
Sign Up to like & getrecommendations! Published in 2017 at "CrystEngComm"
DOI: 10.1039/c7ce01397c
Abstract: A revised thermodynamic model to explain the deviation of the surface composition from that of the bulk (i.e., segregation) is proposed. This phenomenological model is based both on the multilayer approach (i.e., the crystal is… read more here.
Keywords: revised thermodynamic; model; model crystal; thermodynamic model ... See more keywords
Thermodynamic Model for Gas Explosions in Vented and Non-Vented Enclosures
Sign Up to like & getrecommendations! Published in 2017 at "Combustion Science and Technology"
DOI: 10.1080/00102202.2016.1217199
Abstract: ABSTRACT A computer model capable of predicting the thermodynamic properties that occur inside a rigid container during both a non-vented or vented gas explosion is described. The model applies the conservation of mass, energy, and… read more here.
Keywords: non vented; gas; model; vented non ... See more keywords