Results 11 to 20 of about 153,078 (284)
Dynamic pressure variations in the lower crust caused by localized fluid-induced weakening
Communications Earth & Environment, 2022 Localized very high pressure mineral assemblages can be explained by local pressure gradients up to an order of magnitude greater than lithostatic pressure, according to a numerical visco-elasto-plastic model of fluid-induced mechanical ...
Evangelos Moulas +2 more
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B‐DNA Structure and Stability: The Role of Nucleotide Composition and Order
ChemistryOpen, 2022 Invited for this month's cover are the groups of Célia Fonseca Guerra at the Vrije Universiteit Amsterdam and Leiden University, Giampaolo Barone from the Università degli Studi di Palermo, and F.
Celine Nieuwland +4 more
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Process-Structure-Properties-Performance Modeling for Selective Laser Melting
Metals, 2019 Selective laser melting (SLM) is a promising manufacturing technique where the part design, from performance and properties process control and alloying, can be accelerated with integrated computational materials engineering (ICME).
Tatu Pinomaa +5 more
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ChemistryOpen, 2021 Brønsted acid‐catalyzed inverse‐electron demand (IED) aza‐Diels‐Alder reactions between 2‐aza‐dienes and ethylene were studied using quantum chemical calculations.
Song Yu +2 more
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Brain Sciences, 2022 Intracranial aneurysms are pouch-like extrusions from the vessels at the base of the brain which can rupture and cause a subarachnoid hemorrhage.
Aisen Vivas +7 more
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Deep multiscale model learning [PDF]
Journal of Computational Physics, 2020 The objective of this paper is to design novel multi-layer neural network architectures for multiscale simulations of flows taking into account the observed data and physical modeling concepts. Our approaches use deep learning concepts combined with local multiscale model reduction methodologies to predict flow dynamics.
Yating Wang +4 more
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Numerical modelling of diffusion-limited mineral growth for geospeedometry applications [PDF]
Geoscientific Model DevelopmentDiffusion and crystal growth are common processes in nature and can be observed in rocks that have experienced relatively high temperatures. Information about these processes is stored in the composition gradients of minerals.
A. Stroh +5 more
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Arylic C–X Bond Activation by Palladium Catalysts: Activation Strain Analyses of Reactivity Trends
Scientific Reports, 2018 We have quantum chemically explored arylic carbon–substituent bond activation via oxidative insertion of a palladium catalyst in C6H5X + PdLn model systems (X = H, Cl, CH3; Ln = no ligand, PH3, (PH3)2, PH2C2H4PH2) using relativistic density functional ...
Pascal Vermeeren +2 more
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Multiscale modeling of respiration [PDF]
IEEE Engineering in Medicine and Biology Magazine, 2009 A multiscale mathematical model was developed to distinguish responses of external and cellular respiration to exercise of moderate intensity. The simulation shows that the characteristic MRTs of external and cellular respiration are similar even when a transit delay exists between the tissue cells and the lungs.
Haiying, Zhou +3 more
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Novel multiscale modeling tool applied to Pseudomonas aeruginosa biofilm formation. [PDF]
PLoS ONE, 2013 Multiscale modeling is used to represent biological systems with increasing frequency and success. Multiscale models are often hybrids of different modeling frameworks and programming languages. We present the MATLAB-NetLogo extension (MatNet) as a novel
Matthew B Biggs, Jason A Papin
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