Results 171 to 180 of about 3,834,390 (358)
Appendix: Examination of the Employment Environment for Computational Chemistry [PDF]
Donald B. Boyd, Kenny B. Lipkowitz
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This study presents a 3D representative volume element‐based simulation approach to predict mesoscopic residual stress and strain fields in silicon solid solution‐strengthened ductile cast iron. By modeling phase transformation kinetics with an enhanced Johnson–Mehl–Avrami–Kolmogorov model, the effects of varying cooling rates on residual stresses are ...
Lutz Horbach+6 more
wiley +1 more source
Bioinformatics and computational chemistry approaches to explore the mechanism of the anti-depressive effect of ligustilide. [PDF]
Zhang K+4 more
europepmc +1 more source
This study uses real‐time laser diffraction image analysis to quantify fiber diameter changes and whipping behavior from the nozzle to the collector under varying electric field conditions. By capturing diffraction (scattering) intensity changes and bending angles, melt jet and whipping behavior are accurately assessed, supporting melt electrospinning ...
Jihwan Lim+3 more
wiley +1 more source
Computational Chemistry Column: What is Computational Chemistry? A Tentative Answer
J. Weber, H. Huber, H. P. Weber
doaj +2 more sources
This study explores the effects of pixel size and spacing when fabricating electroluminescent (EL) multipixel displays. COMSOL simulations identify the impact of pixel dimensions and spacing on electric field distribution and lighting efficiency. Flexible, high‐resolution EL pixel arrays are reverse offset printed, achieving a 96% reduction in pixel ...
Huanghao Dai+3 more
wiley +1 more source
Registering the Amica electronic structure code in the Extensible Computational Chemistry Environment [PDF]
Robert J. Gdanitz+4 more
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The fused filament‐fabricated MAR‐M247 alloy without hot isostatic pressing shows the lowest porosity of 4%. Heat treatment at 1220 °C produces coarse precipitates and carbides. Specimens heat‐treated at 1220 °C exhibit higher tensile strength (683 MPa) and elongation (10%) at room temperature.
Haneen Daoud+7 more
wiley +1 more source