Results 11 to 20 of about 95,657 (238)
A critical examination of compound stability predictions from machine-learned formation energies [PDF]
, 2020 Machine learning has emerged as a novel tool for the efficient prediction of material properties, and claims have been made that machine-learned models for the formation energy of compounds can approach the accuracy of Density Functional Theory (DFT ...
Bartel, CJ +5 more
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Possibilities of cloud educational technologies in the study of physical chemistry
CTE Workshop Proceedings, 2013 Opening of Mathcad Calculation Server (MCS) (http://www.vpu.ru/mas) at the Moscow Power Engineering Institute made it possible to create and implement an interactive reference book of physico-chemical quantities and thermodynamic database (http://twt ...
D. G. Naryshkin
doaj +1 more source
Energies, 2020 This research presents the development of R463A refrigerant, a nonflammable refrigerant that was retrofitted to replace R404A. R463A is primarily composed of hydrofluorocarbons/hydrocarbons/carbon dioxide (HFCs/HCs/CO2), and has global-warming potential (
Piyanut Saengsikhiao +4 more
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First-Principles-Based Thermodynamic Description of Solid Copper Using the Tight-Binding Approach [PDF]
, 2002 A tight-binding model is fit to first-principles calculations for copper that include structures distorted according to elastic constants and high-symmetry phonon modes.
Albers, R. C. +3 more
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Journal of Cheminformatics, 2019 A priori calculation of thermophysical properties and predictive thermodynamic models can be very helpful for developing new industrial processes. Group contribution methods link the target property to contributions based on chemical groups or other ...
Simon Müller
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The Misselhorn Cycle: Batch-Evaporation Process for Efficient Low-Temperature Waste Heat Recovery
Energies, 2016 The concept of the Misselhorn cycle is introduced as a power cycle that aims for efficient waste heat recovery of temperature sources below 100 °C. The basic idea shows advantages over a standard Organic Rankine Cycle (ORC) in overall efficiency and ...
Moritz Gleinser, Christoph Wieland
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Journal of Sustainable Development of Energy, Water and Environment Systems, 2018 The aim of the paper is to examine the possibility of application of the spreadsheet calculator and Reference Fluid Thermodynamic and Transport Properties database to a thermodynamic process.
Robert Bedoić, Veljko Filipan
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On the thermal and thermodynamic (In)stability of methylammonium lead halide perovskites [PDF]
, 2016 The interest of the scientific community on methylammonium lead halide perovskites (MAPbX3, X = Cl, Br, I) for hybrid organic-inorganic solar cells has grown exponentially since the first report in 2009.
Brunetti, Bruno +4 more
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Relationship between solidification microstructure and hot cracking susceptibility for continuous casting of low-carbon and high-strength low-alloyed steels: A phase-field study [PDF]
, 2013 © The Minerals, Metals & Materials Society and ASM International 2013Hot cracking is one of the major defects in continuous casting of steels, frequently limiting the productivity.
A. Choudhury +40 more
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Chemical Engineering Transactions, 2014 This paper evaluates the thermodynamic performance and costs of biomethane production plants tailored to the Italian scenario, by comparing the competitiveness of a water wash based biogas upgrading plant against a conventional biogas-to-electricity ...
G. Bortoluzzi +3 more
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