Results 131 to 140 of about 14,571 (201)

Materials Database from All-electron Hybrid Functional DFT Calculations. [PDF]

Sci Data
Nair AS, Foppa L, Scheffler M.
europepmc   +1 more source

Radium Speciation in Simulated Digestive Biofluids: Insights from Electrospray Ionization Mass Spectrometry and Thermodynamic Modeling

Analysis &Sensing, EarlyView.
Electrospray ionization mass spectrometry (ESI‐MS) combined with thermodynamic modeling provides the first direct characterization of radium speciation in synthetic gastrointestinal biofluids. Free Ra2+ ions predominate with minimal protein binding and negligible EDTA complexation. Crown ethers enable effective Ra complexation.
Linus Holtmann, Tim Schmalz, Tobias Weissenborn, Felix Stäger, Beate Riebe, Clemens Walther   +5 more
wiley   +1 more source

Incorporating the thermodynamic effects of temperature and pressure on modeling neuronal gating kinetics. [PDF]

PLoS One
Miller JA, Pahlavan B, Gamboa B, Santamaria F.   +3 more
europepmc   +1 more source

A Review on Magnesium Based Metal Hydrides for Thermal Energy Storage Systems

Asia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT The hydrogen storage in metal hydrides is an imminent, innovative, and environmentally beneficial approach that offers benefits for example, an ample amount of storage and elasticity in terms of thermodynamics necessary for hydrogen absorption and release.
Asif Nizam, Prem Kumar Chaurasiya, Vinod Kumar Sharma, Ranjith Krishna Pai   +3 more
wiley   +1 more source

Pathway thermodynamic analysis postulates change in glutamate metabolism as a key factor in modulating immune responses. [PDF]

Immunometabolism (Cobham)
Malla S, Saha R.
europepmc   +1 more source

Performance Investigation of Eco‐Friendly Refrigerant Mixtures as an Alternative to R134a in Vapour‐Compression Refrigeration System

Asia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT The growing impacts of climate change and energy scarcity demand environmentally sustainable refrigeration solutions. This study investigates eco‐friendly refrigerants (R152a, R290 and R600a) and their optimized ternary mixture as alternatives to R134a. Four blend compositions were analysed using experimental testing and REFPROP 10.0 modelling
M. Periyasamy, P. Senthilkumar
wiley   +1 more source

Physically interpretable descriptors drive the materials design of metal hydrides for hydrogen storage. [PDF]

Chem Sci
Jang SH, Zhang D, Tran HB, Jia X, Konno K, Sato R, Orimo SI, Li H.   +7 more
europepmc   +1 more source

Design and Optimization of a Novel Kalina‐Organic Rankine Cycle System Based on LNG Cold Energy Utilization

Asia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT This study proposes a novel integrated system (SDKC‐DORC) that combines a split‐flow dual‐pressure Kalina cycle with a secondary organic Rankine cycle for the synergistic utilization of solar energy and liquefied natural gas (LNG) cold energy.
Ke Xiao, Kun Wang, Wenquan Jiang, Fan Yang, Changshun Wang, Chengjie Su, Junjie Liu   +6 more
wiley   +1 more source

Dimensionality reduction of COSMO-RS molecular descriptor using functional principal component analysis (FPCA) for organic solvent mapping. [PDF]

RSC Adv
Ramirez Cardenas LE, Ouaret R, Gerbaud V, Rodriguez Donis I, Thiebaud-Roux S.   +4 more
europepmc   +1 more source

Methane Pyrolysis Performance in Catalytic Molten Media for Hydrogen Production From the Perspective of Bubble Column Reactor Design and Configuration

Asia-Pacific Journal of Chemical Engineering, EarlyView.
ABSTRACT In the hydrogen production routes from natural gas (methane), methane pyrolysis offers a cleaner option than the established steam methane reforming by producing CO2‐free hydrogen. However, in fixed bed reactors over solid catalysts, this technology experiences rapid catalyst deactivation due to carbon (coke) deposition encapsulating its ...
Muhammad Irfan Fakarudin, Luqmanulhakim Baharudin, Matthew J. Watson, Wan Nor Roslam Wan Isahak   +3 more
wiley   +1 more source