MMA‐EoS: A Computational Framework for Mineralogical Thermodynamics
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Geophysical Research"
DOI: 10.1002/2017jb014501
Abstract: A striking feature of the Indian Ocean is a distinct geoid low south of India, pointing to a regionally anomalous mantle density structure. Equally prominent are rapid plate convergence rate variations between India and SE… read more here.
Keywords: computational framework; thermodynamics; mma eos; mineralogical thermodynamics ... See more keywords
Prioritizing Hetero‐Metallic Interfaces via Thermodynamics Inertia and Kinetics Zincophilia Metrics for Tough Zn‐Based Aqueous Batteries
Sign Up to like & getrecommendations! Published in 2023 at "Advanced Materials"
DOI: 10.1002/adma.202209288
Abstract: Poor thermodynamic stability and sluggish electrochemical kinetics of metallic Zn anode in aqueous solution greatly hamper its practical application. To solve such problems, to date, various zincophilic surface modification strategies are developed, which can facilitate… read more here.
Keywords: metallic interfaces; thermodynamics; hetero metallic; thermodynamics inertia ... See more keywords
Accelerated Chemical Thermodynamics of Uranium Extraction from Seawater by Plant-Mimetic Transpiration.
Sign Up to like & getrecommendations! Published in 2021 at "Advanced science"
DOI: 10.1002/advs.202102250
Abstract: The extraction of uranium from seawater, which is an abundant resource, has attracted considerable attention as a viable form of energy-resource acquisition. The two critical factors for boosting the chemical thermodynamics of uranium extraction from… read more here.
Keywords: seawater; extraction; uranium extraction; plant ... See more keywords
Graphene‐Tailored Thermodynamics and Kinetics to Fabricate Metal Borohydride Nanoparticles with High Purity and Enhanced Reversibility
Sign Up to like & getrecommendations! Published in 2018 at "Advanced Energy Materials"
DOI: 10.1002/aenm.201702975
Abstract: Due to their ultrahigh theoretical capacity, metal borohydrides are considered to be one of the most promising candidate hydrogen storage materials. Their application still suffers, however, from high operating temperature, sluggish kinetics, and poor reversibility.… read more here.
Keywords: reversibility; thermodynamics; graphene; thermodynamics kinetics ... See more keywords
Validity of Egyptian Na‐montmorillonite for adsorption of Pb2+, Cd2+ and Ni2+ under acidic conditions: characterization, isotherm, kinetics, thermodynamics and application study
Sign Up to like & getrecommendations! Published in 2017 at "Asia-Pacific Journal of Chemical Engineering"
DOI: 10.1002/apj.2072
Abstract: This study investigated the applicability of natural Egyptian Na-montmorillonite (Na-MMT) to remove Pb2+, Cd2+ and Ni2+ under acidic conditions that mimic industrial wastewater acidity. Cation exchange capacity of Na-MMT was found 91 meq/100 g and the specific… read more here.
Keywords: cd2 ni2; adsorption; pb2 cd2; thermodynamics ... See more keywords
Thermodynamics and kinetics control of support layer synthesis for enhanced thin film composite membrane performance
Sign Up to like & getrecommendations! Published in 2018 at "Journal of Applied Polymer Science"
DOI: 10.1002/app.45802
Abstract: The desalination performance of a thin film composite (TFC) membrane hinges highly on the surface characteristics of support membrane. In this study, good wettability, regular pore size, and moderate roughness were identified as the critical… read more here.
Keywords: thermodynamics; thin film; performance; membrane ... See more keywords
Modeling a propionate‐oxidizing syntrophic coculture using thermodynamic principles
Sign Up to like & getrecommendations! Published in 2022 at "Biotechnology and Bioengineering"
DOI: 10.1002/bit.28156
Abstract: A coculture of Syntrophobacter fumaroxidans and Methanospirillum hungatei was modeled using four biokinetic models, which only differed by the functions used to describe the growth yields (dynamic or constant) and the hydrogen inhibition function (noncompetitive… read more here.
Keywords: thermodynamics; coculture; oxidizing syntrophic; propionate oxidizing ... See more keywords
Thermodynamics Affecting Glacier-Released 4-Nonylphenol Deposition in Alaska, USA.
Sign Up to like & getrecommendations! Published in 2022 at "Environmental toxicology and chemistry"
DOI: 10.1002/etc.5343
Abstract: Glaciers have recently been recognized as a secondary source of organic pollutants. As glacier melt rates increase, downstream ecosystems are at increasing risk of exposure to these pollutants. Nonylphenols (NPs) are well documented anthropogenic persistent… read more here.
Keywords: downstream; thermodynamics; alaska usa; deposition ... See more keywords
A component analysis of the free energies of folding of 35 proteins: A consensus view on the thermodynamics of folding at the molecular level
Sign Up to like & getrecommendations! Published in 2017 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.25072
Abstract: What factors favor protein folding? This is a textbook question. Parsing the experimental free energies of folding/unfolding into diverse enthalpic and entropic components of solute and solvent favoring or disfavoring folding is not an easy… read more here.
Keywords: methodology; thermodynamics; free energies; consensus view ... See more keywords
Towards improved FAIRness of the ThermoML Archive
Sign Up to like & getrecommendations! Published in 2022 at "Journal of Computational Chemistry"
DOI: 10.1002/jcc.26842
Abstract: The ThermoML Archive is a subset of Thermodynamics Research Center (TRC) data holdings corresponding to cooperation between NIST TRC and five journals: Journal of Chemical Engineering and Data (ISSN: 1520‐5134), The Journal of Chemical Thermodynamics… read more here.
Keywords: thermoml archive; thermodynamics; improved fairness; fairness thermoml ... See more keywords
Regulating the Thermodynamics and Thermal Properties of Depolymerizable Polycyclooctenes through Substituent Effects.
Sign Up to like & getrecommendations! Published in 2022 at "Macromolecular rapid communications"
DOI: 10.1002/marc.202200304
Abstract: Chemical recycling to monomer (CRM) is a promising route for transitioning to a circular polymer economy. To develop new CRM systems with useful properties, it is important to understand the effects of monomer structure on… read more here.
Keywords: thermal properties; regulating thermodynamics; thermodynamics; properties depolymerizable ... See more keywords