Keywords: انرژی آزاد گیبس; Carbon Dioxide; Thermodynamic Analysis; Methanation; Gibbs free energy
مقالات ISI انرژی آزاد گیبس (ترجمه نشده)
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Thermodynamic properties of solid electrolyte Li7La3Zr2O12
Keywords: انرژی آزاد گیبس; Li7La3Zr2O12; Solid electrolyte; Heat capacity; Entropy; Gibbs free energy; Neumann-Kopp rule;
Heat capacities, entropies, and Gibbs free energies of formation of low-k amorphous Si(O)CH dielectric films and implications for stability during processing
Keywords: انرژی آزاد گیبس; Heat capacity; Entropy; Gibbs free energy; Amorphous low-k SiOCH films; Formation enthalpy; Thermodynamic stability;
Manufacturing of a hierarchical carbon foam with tailored catalytically Me/MexOy particles
Keywords: انرژی آزاد گیبس; CVD process; Electron microscopy; TGA; Gibbs free energy; Grain size distribution;
Evidence of formation of lithium compounds on FTU tiles and dust
Keywords: انرژی آزاد گیبس; Fusion; Lithium; Plasma-wall interaction; XPS; FTIR; SIMS; Gibbs free energy;
Quantum chemical calculations to determine partitioning coefficients for HgCl2 on iron-oxide aerosols
Keywords: انرژی آزاد گیبس; Density functional theory; Gas-to-particle phase partitioning; Ab-initio phase diagram; Predictive tool; Adsorption; Gibbs free energy;
H2S-CO2 mixture corrosion-resistant Fe2O3-amended wellbore cement for sour gas storage and production wells
Keywords: انرژی آزاد گیبس; Oil well cement; Gibbs free energy; H2S; CO2; Mixtures corrosion;
Origin of microporosity in chalcogen-doped carbon materials: The case of selenium-doped carbogels
Keywords: انرژی آزاد گیبس; Selenium; Carbon gel; Heteroatom doping; Chalcogen; Ultramicroporosity; Gibbs free energy;
The behavior of Ca and its compounds in Si during the slag refining with CaO-SiO2-CaF2 system under air atmosphere
Keywords: انرژی آزاد گیبس; Impurities; Calcium; Silicon; Slag treatment; Gibbs free energy; Segregation;
Specific and highly efficient condensation of GC and IC DNA by polyaza pyridinophane derivatives
Keywords: انرژی آزاد گیبس; AFM; atomic force microscopy; AT-DNA; apoly dA - poly dT; CD; circular dichroism; ctDNA; calf thymus DNA; ds-DNA; double stranded DNA; ÎrG°; Gibbs free energy; ÎrH°; enthalpy; ÎrS°; entropy; EB; ethidium bromide; EMF; electromotive force; ESI; ele
Reduction of Gibbs free energy and enhancement of Methanosaeta by bicarbonate to promote anaerobic syntrophic butyrate oxidation
Keywords: انرژی آزاد گیبس; Gibbs free energy; Methanogens; Bicarbonate; Anaerobic digestion; Syntrophic;
Bioinformatics analysis of non-synonymous variants in the KLF genes related to cardiac diseases
Keywords: انرژی آزاد گیبس; KLF; Kruppel-like Factors; ZF; zinc-finger; HCM; hypertrophic cardiomyopathy; Nkx2; NK2 Homeobox; Nkx2.5; NK2 Homeobox 5; TBX5; T-box transcription factor 5; Sp1; transcription factor Sp1; CtBP; Carboxy-terminal binding protein; Sin3A; SIN3 transcription
Low-temperature and low-H2 pressure synthesis of hydride semiconductor YH3 âδusing Pd/Ni co-capped Y films
Keywords: انرژی آزاد گیبس; Y; YH2; YH3; Hydrogen; Catalysis layer; Gibbs free energy; Pd; Ni;
Effect of Cr contents on the diffusion behavior of Te in Ni-based alloy
Keywords: انرژی آزاد گیبس; Te; Ni-Cr alloy; Diffusion; Gibbs free energy; Intergranular embrittlement;
Are the inorganic B24N24, Al24N24, B24P24 and Al24P24 nanoclusters synthesizable or not? A DFT study
Keywords: انرژی آزاد گیبس; Nanoclusters; Stability; DFT; Gibbs free energy;
Size dependent structural stability of Mo, Ru, Y and Sc nanoparticles
Keywords: انرژی آزاد گیبس; Size effect; Phase transition; Nanoparticles; Gibbs free energy; Phase diagram;
Ab initio study of cationic water cluster (H2O)9+ via particle swarm optimization algorithm
Keywords: انرژی آزاد گیبس; Isomer of (H2O)9+; Vibration analysis; Gibbs free energy; Topological analysis;
Ab initio investigation of possible candidate structures and properties of water cluster (H2O)7+ via particle swarm optimization method
Keywords: انرژی آزاد گیبس; (H2O)7+ cluster; Gibbs free energy; Singly occupied molecule orbital (SOMO); Vibrational analysis; Topological analysis;
Elucidating ozonation mechanisms of organic micropollutants based on DFT calculations: Taking sulfamethoxazole as a case
Keywords: انرژی آزاد گیبس; Ozonation mechanism; Organic micropollutant; Sulfamethoxazole; Density functional theory; Gibbs free energy;
Bioelectrochemical conversion of waste to energy using microbial fuel cell technology
Keywords: انرژی آزاد گیبس; ABTS; 2,2'-azino-bis(3-ethylbenzothiazoline-6-sulphonic acid); AC; activated carbon; AD; anaerobic digestion; ATP; Adenosine Triphosphate; BES; bioelectrochemical systems; B-MFC; bottle microbial fuel cell; BTU; British Thermal Units; CB; carbon black; CD
Thermodynamic studies of zippeite, a uranyl sulfate common in mine wastes
Keywords: انرژی آزاد گیبس; Zippeite; Uranyl sulfate; Uranium mine waste; Calorimetry; Solubility; Enthalpy; Entropy; Gibbs free energy;
Dye regeneration mechanisms of dye sensitized solar cells: Quantum chemical studies on the interaction between iodide and O/S-containing organic dyes
Keywords: انرژی آزاد گیبس; Organic dye regeneration; Density functional theory; Dye sensitized solar cells; Gibbs free energy; Reaction mechanism
Thermodynamic equilibrium distribution of light olefins in catalytic pyrolysis
Keywords: انرژی آزاد گیبس; Catalytic pyrolysis; Thermodynamic equilibrium; Gibbs free energy; Ethene; Propene
Carbonation resistance cement for CO2 storage and injection wells
Keywords: انرژی آزاد گیبس; Well cementing; Carbonation; Gibbs free energy; CO2;
Evaluation method of iodine re-evolution from an in-containment water pool after a loss of coolant accident, Part I: pH estimation of a solution with various chemicals
Keywords: انرژی آزاد گیبس; Gibbs free energy; Iodine re-evolution; LOCA; IRWST; pH;
High temperature mass spectrometric studies on UGa system: Thermodynamic properties over (U3Ga5Â +Â UGa2) and (UGa2Â +Â UGa3) phase regions
Keywords: انرژی آزاد گیبس; Vaporisation; UGa; Gibbs free energy; Knudsen effusion mass spectrometry; Enthalpy of formation;
A survey on mechanisms and critical parameters on solidification of selective laser melting during fabrication of Ti-6Al-4V prosthetic acetabular cup
Keywords: انرژی آزاد گیبس; Acetabular shell; Gibbs free energy; Selective laser melting; Surface energy; Solidification; Thermal stress
Study on Dendritic Growth in Pressurized Solidification of Mg-Al Alloy Using Phase Field Simulation
Keywords: انرژی آزاد گیبس; Phase field; Pressurized solidification; Dendritic growth; Mg-Al alloy; Gibbs free energy;
Diversity of monomeric dioxo chromium species in Cr/silicalite-2 catalysts: A hybrid density functional study
Keywords: انرژی آزاد گیبس; BCP; bond critical point; DFT; density functional theory; FMO; frontier molecular orbital; HDPE; high-density polyethylene; HOMO; highest occupied molecular orbital; LUMO; lowest unoccupied molecular orbital; NBO; natural bond orbital; NNN; next-nearest-n
Interaction of cationic amphiphilic drug nortriptyline hydrochloride with TX-100 in aqueous and urea solutions and the studies of physicochemical parameters of the mixed micelles
Keywords: انرژی آزاد گیبس; Antidepressant drug; TX-100; Critical micelle concentration; Activity coefficients; Gibbs free energy; Stability;
Estimation of evaporation rate of cesium from hot sodium pool to inert cover gas of typical SFR
Keywords: انرژی آزاد گیبس; Sodium; Cesium; Evaporation rate; Activity coefficient; Equilibrium partition coefficient; Gibbs free energy
Ab initio investigation of structure, stability, polarizability, and electronic structure of Ga4As4 cluster
Keywords: انرژی آزاد گیبس; Ga4As4 cluster; Gibbs free energy; Polarizability; Electronic structure;
Does crystallographic anisotropy prevent the conventional treatment of aqueous mineral reactivity? A case study based on K-feldspar dissolution kinetics
Keywords: انرژی آزاد گیبس; Orthoclase; Dissolution; Kinetic rate laws; Gibbs free energy; Crystallographic orientation; Dissolution anisotropy
Vibrational, NMR and UV–Visible spectroscopic investigation, VCD and NLO studies on Benzophenone thiosemicarbazone using computational calculations
Keywords: انرژی آزاد گیبس; Benzophenone thiosemicarbazone; Perturbation; Gibbs free energy; CS ligand; VCD
Measurement and analysis of adsorption isotherms of CO2 on activated carbon
Keywords: انرژی آزاد گیبس; Activated carbon; Carbon dioxide; Adsorption isotherms; Isosteric heat of adsorption; Gibbs free energy;
Solubility of glycine and DL-nor-valine in aqueous solutions of NaNO3 and KNO3 and measurements of transfer thermodynamics
Keywords: انرژی آزاد گیبس; Glycine; DL-nor-valine; Solubility; Electrolyte; Gibbs free energy; Entropy;
Sintering additives for SiC based on the reactivity: A review
Keywords: انرژی آزاد گیبس; SiC; Sintering; Densification; Gibbs free energy;
Enhancement of corrosion resistance for plasma nitrided AISI 4140 steel by plain air plasma post-oxidizing
Keywords: انرژی آزاد گیبس; Plasma post-oxidation; Plain air; Gibbs free energy; Corrosion resistance; AISI 4140 steel;
Aggregation of a Zn(II)-salen complex: Theoretical study of structure and spectra
Keywords: انرژی آزاد گیبس; Zn-complexes; DFT; Zn-salen dimerization; Rotational barrier; Gibbs free energy;
Thermodynamics of the pseudobinary GaAs1-xBix (0 â¤Â x â¤Â 1) alloys studied by different exchange-correlation functionals, special quasi-random structures and Monte Carlo simulations
Keywords: انرژی آزاد گیبس; Gallium arsenide; Bismide; Gibbs free energy; Immiscibility; Spinodal decomposition; Surface;
Carbon deposition thresholds on nickel-based solid oxide fuel cell anodes II. Steam:carbon ratio and current density
Keywords: انرژی آزاد گیبس; Solid oxide fuel cell; Carbon deposition; Threshold; Steam; Current; Gibbs free energy
Phasego: A toolkit for automatic calculation and plot of phase diagram
Keywords: انرژی آزاد گیبس; Quasi-harmonic approximation; Gibbs free energy; Phase diagram; Thermodynamic properties
Assessment of ζ-potential in TiO2 aqueous suspensions: A comparative study based on thermodynamic and rheological methods
Keywords: انرژی آزاد گیبس; Critical ζ-potential; Titanium dioxide; Gibbs free energy; Yield stress; Rheology
Kinetics of CO2-fluid-rock reactions in a basalt aquifer, Soda Springs, Idaho
Keywords: انرژی آزاد گیبس; Carbon sequestration; CO2-water-rock interaction; Feldspar dissolution; Gibbs free energy; Blackfoot Volcanic Field; Soda Springs;
Physicochemical nature of interfaces controlling ferredoxin NADP+ reductase activity through its interprotein interactions with ferredoxin
Keywords: انرژی آزاد گیبس; Fd; ferredoxin; PETF; plant-type photosynthetic electron transport ferredoxin; FNR; ferredoxin NADP+ reductase; SiR; sulfite reductase; CD; circular dichroism; CSP (Îδtot); chemical shift perturbation; FAD; flavin adenine dinucleotide; HSQC; heteronucle
Modelling the impact of geochemical reactions on hydrocarbon phase behavior during CO2 gas injection for enhanced oil recovery
Keywords: انرژی آزاد گیبس; Gibbs free energy; Hydrocarbon phase behavior; Geochemical reactions; CO2 sequestration; CO2 EOR
Structural exploration and properties of (H2O)4+ cluster via ab initio in combination with particle swarm optimization method
Keywords: انرژی آزاد گیبس; Gibbs free energy; Vibrational analysis; Singly occupied orbital; Cationic water cluster; Ab initio calculation;
A thermodynamic investigation of the cellulose allomorphs: Cellulose(am), cellulose Iβ(cr), cellulose II(cr), and cellulose III(cr)
Keywords: انرژی آزاد گیبس; Cadoxen; Calorimetry; Cellulose amorphous; Cellulose I; Cellulose II; Cellulose III; Enthalpy; Entropy; Gibbs free energy; Heat capacity; NMR;
A proposal to use excess Gibbs energy rather than HLB number as an indicator of the hydrophilic-liphophilic behavior of surfactants
Keywords: انرژی آزاد گیبس; Gibbs free energy; Hydrophilic-lipophilic balance; HLB; Surfactants;
Transition metal decorated borazine complex for hydrogen storage and unfavourable consequence of spin shift for hydrogen storage on Ti-decorated borazine: A DFT study
Keywords: انرژی آزاد گیبس; Transition metal; Binding energy; Gibbs free energy; Density functional theory;