20a, b. Compared with CPU serial program, the computational efficiency for simulating eutectic growth based on GPU has increased by two orders of magnitude, as shown in Fig. 20c. However, the calculation time of
Enhancing electrical dcoiondtaecs.t,BruetdHucgiPnbgBdre3npsliatyysdaefbeicgtgsedruprainrtgbtertawnesmenistshieontwcoarbreiecraulosses,oaf nitds achieving high power efficiency conversion were the main goals of our research using DFT m ethodologies41. As a result, the results of the ...
in the context of optimization or parameter identification problems, where a large number of evaluations has to be performed, a fast surrogate model should be designed for efficiency reasons. The solutions of Darcy’s flow problem can be considered as the stationary state of a diffusion process. ...
Alkyl effects on the chain initiation efficiency of olefin polymerization by cationic half-sandwich scandium catalysts: A DFT study. Organometallics 2016, 35, 913–920. [CrossRef] 50. Kang, X.H.; Luo, Y.; Zhou, G.L.; Wang, X.B.; Yu, X.R.; Hou, Z.M.; Qu, J.P. Theoretical ...
Thermal efficiency in hybrid (Al2O3-CuO/H2O) and tri-hybrid (Al2O3-CuO-Cu/H2O) nanofluids between converging/diverging channel with viscous dissipation function: Numerical analysis. Front. Chem. 2022, 10, 960369. [CrossRef] 37. Ullah, M.Z. Radiative and Darcy-Forchheimer hybrid nanofluid ...
theoretical capacity of 712 mAh/g based on three-electron transfer. The achievement of high-voltage conversion reaction renders FeF3a potential cathode candidate for LMBs while most conversion reactions are relevant for anodic functions. However, its conversion activity and efficiency are limited by ...
This is in contrast to strongly non-local models formulated via the CDFT of freezing87,88, atomic density field theory (ADFT: e.g., refs. 73,89), or PF crystal (PFC: e.g., refs. 78,90,91). A number of (higher-order) weakly non-local approximations of PFC have also been ...
(a) (b) d. Calculate the expansion vector Di for each pair of vertices, by multiplying the Figure 2s.u(ma) Soofftthbeodnyorinmtahlevbeecgtionrnsinogf; s(ub)msomftabnoddsyoafftNeri saenvderNalis+te1psoof fthAelgvoerritthemx p1a. irs from Algorithm 1 the expansion factor E. e. ...
The flow rate of the piezoelectric-hydraulic pump is an important criterion for evaluating pump efficiency. Therefore, a study on the parameters affecting such a flow rate is necessary to enhance the efficiency of piezoelectric hydraulic pumps used in brake systems. This study on small piezoelectric...
2.3.2. Density Functional Theory (DFT) Calculations The majority of compounds examined in this research comprised S,S/R,R enantiomers. This observation, coupled with the enhanced cytotoxicity exhibited by these enantiomeric compounds (specifically, MMZ-45AA and -147B compounds compared to MMZ-45B ...