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Mi-An Xue, Xiaoli Yuan, Cheng Zhong and Peng Wan
Co2Zr and Co2Ti are both cubic crystals with a Cu2Mg-type structure. The elastic, thermodynamic and electronic properties of the intermetallic compounds Co2Zr and Co2Ti are investigated by using ab initio plane-wave pseudopotential density functional the...
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Cindy Trinh, Silvia Lasala, Olivier Herbinet and Dimitrios Meimaroglou
This article investigates the applicability domain (AD) of machine learning (ML) models trained on high-dimensional data, for the prediction of the ideal gas enthalpy of formation and entropy of molecules via descriptors. The AD is crucial as it describe...
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Mieszko Kolodziej and Zbigniew Sniadecki
The alloys that crystallize in a tetragonal ThMn12-type (space group I4/mmm) structure and are based on Fe and rare earth elements are believed to have a potential to plug the performance gap between ferrite and Nd-based magnets. Nevertheless, the progre...
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Roberto Zivieri
The study of the thermodynamic properties of topological defects is important not only for understanding their magnetic properties but also for suggesting novel applications. In this paper, the statistical and statistical thermodynamic properties of a po...
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Dalibor Peru?ko, Damir Karabaic, Ivan Bajsic and Jo?e Kutin
During LNG storage and transportation by ship, a fraction of the LNG in the cryogenic tanks evaporates due to heat ingress through the insulation, resulting in boil-off gas (BOG) production and a change in LNG composition, a phenomenon known as LNG agein...
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Francileni Pompeu Gomes, Osvaldo Resende, Elisabete Piancó de Sousa, Juliana Aparecida Célia and Kênia Borges de Oliveira
Jambu is a vegetable originally from the northern region of Brazil, has bioactive properties, being little explored by other regions, due to its high peresivity. And one of the methods to increase the shelf life of plant products is the removal of water....
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Kyoichi Tezuka, Tatsuhiko Taguchi, Saman Alavi, Amadeu K. Sum and Ryo Ohmura
This paper report analyses of thermodynamic stability of structure-H clathrate hydrates formed with methane and large guest molecules in terms of their gas phase molecular sizes and molar masses for the selection of a large guest molecule providing bette...
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Kai Xu, Willie F. Harper Jr, Dongye Zhao
Pág. 3146 - 3152
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Robert J. Meier
Physicochemical properties of chemicals as referred to in this review include, for example, thermodynamic properties such as heat of formation, boiling point, toxicity of molecules and the fate of molecules whenever undergoing or accelerating (catalytic)...
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Per Söderlind, Aurélien Perron, Emily E. Moore, Alexander Landa and Tae Wook Heo
Density-functional theory (DFT) is employed to investigate the thermodynamic and ground-state properties of bulk uranium tri-iodide, UI3. The theory is fully relativistic and electron correlations, beyond the DFT and generalized gradient approximation, a...
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Lucia Tagami, Onelia Aparecida Andreo dos Santos, Eduardo Falabella Sousa-Aguiar, Pedro Augusto Arroyo, Maria Angélica Simões Dornellas de Barros (Author)
Pág. 1351 - 1357
Isotherm ion exchange of Y zeolite has been studied at different temperatures. The direct exchanges of chromium in NaY show a very high selectivity to the in-going Cr3+ ion. It was also shown that exchange increases with increasing temperature. On the ot...
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Zhifu Lin, Dasheng Xiao and Hong Xiao
Flow through complex thermodynamic machinery is intricate, incorporating turbulence, compressibility effects, combustion, and solid?fluid interactions, posing a challenge to classical physics. For example, it is not currently possible to simulate a three...
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Iva Zokic and Jasna Prlic Kardum
Because of the specific thermodynamic properties of active pharmaceutical ingredients, the process of crystallization often meets implementation challenges in the pharmaceutical industry. Therefore, it is essential to select the appropriate method and sy...
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Michal Schmirler
In the context of aircraft aerodynamics, the compressibility of air flowing around the aircraft must always be considered. This fact brings with it one inconvenience: to evaluate the velocity of the flowing air (airspeed), it is necessary to know its tem...
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Luigi Calabrese, Stefano De Antonellis, Salvatore Vasta, Vincenza Brancato and Angelo Freni
In this work, novel silicone-SAPO34 composite materials are proposed for application in adsorption thermal energy storage systems. The innovative composite materials were obtained through a mold foaming process activated by a dehydrogenative coupling rea...
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Nur Ardiana Amirsom, Md. Jashim Uddin, Md Faisal Md Basir, Ali Kadir, O. Anwar Bég and Ahmad Izani Md. Ismail
This paper studies the combined effects of viscous dissipation, first and second-order slip and variable transport properties on phase-change hydromagnetic bio-nanofluid convection flow from a stretching sheet. Nanoscale materials possess a much larger s...
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Samuel Sami
A numerical simulation model for a novel concept of a hybrid composed of photovoltaic-thermal solar panels and a heat pump is presented. This concept was developed to assess the performance and energy conversion efficiency of the hybrid system used to pr...
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This work explores the possibility to adopt in organic Rankine cycle (ORC) plants mixtures of water (acting as solvent) plus an organic compound (acting as solute) as the working fluid. Initially an evaluation of the thermodynamic properties of the mixtu...
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Eniko Manek, Etelka Tombácz, Erik Geissler, Krisztina László
Pág. 39 - 50
Major, still unelucidated, inconsistencies exist in the literature among measurements of the thermodynamic properties of poly(N-isopropylacrylamide) (PNIPAM) solutions and gels. This paper looks for evidence of intrinsic ionic behaviour in cross-linked P...
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