Search results for " function"
showing 10 items of 9395 documents
Forward Kinematic Modelling with Radial Basis Function Neural Network Tuned with a Novel Meta-Heuristic Algorithm for Robotic Manipulators
2022
The complexity of forward kinematic modelling increases with the increase in the degrees of freedom for a manipulator. To reduce the computational weight and time lag for desired output transformation, this paper proposes a forward kinematic model mapped with the help of the Radial Basis Function Neural Network (RBFNN) architecture tuned by a novel meta-heuristic algorithm, namely, the Cooperative Search Optimisation Algorithm (CSOA). The architecture presented is able to automatically learn the kinematic properties of the manipulator. Learning is accomplished iteratively based only on the observation of the input–output relationship. Related simulations are carried out on a 3-Degrees…
Adaptive Tracking Control of Nonlinear Time-Varying Systems with Unknown Control Coefficients and Unknown Time-Varying Parameters
2019
This paper investigates the tracking control of a class of strict-feedback uncertain nonlinear systems in the presence of unknown signs of control coefficients and unknown time-varying parameters as well as unknown disturbances. A robust adaptive controller and a new decoupled backstepping approach to stability analysis are developed by constructing a new compensation scheme. By introducing a Nussbaum function and a new type of hyperbolic tangent function, the effects of unknown time-varying parameters and unknown control coefficients are effectively compensated. By using the decoupled backstepping technique, it is proved that under the proposed control, all closed-loop states are uniform u…
Suitability of the VOF Approach to Model an Electrogenerated Bubble with Marangoni Micro-Convection Flow
2022
When a hydrogen or oxygen bubble is created on the surface of an electrode, a micro-convective vortex flow due to the Marangoni effect is generated at the bottom of the bubble in contact with the electrode. In order to study such a phenomenon numerically, it is necessary to be able to simulate the surface tension variations along with a liquid-gas interface, to integrate the mass transfer across the interface from the dissolved species present in the electrolyte to the gas phase, and to take into account the moving contact line. Eulerian methods seem to have the potential to solve this modeling. However, the use of the continuous surface force (CSF) model in the volume of fluid (VOF) framew…
Vadīšanas funkciju izpildes analīze Viļakas novada pašvaldībā.
2016
Bakalaura darba tēma ir “Vadīšanas funkciju izpildes analīze Viļakas novada pašvaldībā”. Darbā ir apskatītas vadīšanas funkcijas – organizēšana, plānošana, motivēšana, koordinēšana un kontrole, fokusējoties uz pirmajām trim minētajām. Bakalaura darba mērķis ir izanalizēt vadīšanas funkciju izpildi Viļakas novada domes administrācijā, pievēršot pastiprinātu uzmanību organizēšanai, motivēšanai un plānošanai. Lai šo mērķi izpildītu, pirmajā daļā autore izpētīja dažādus teorijas avotus, otrajā daļā pētīja organizāciju un tās darbību, trešajā daļā anketēja darbiniekus un intervēja nodaļas vadītāju. Darbs sastāv no ievada, teorētiskās daļas un praktiskās daļas, secinājumiem un priekšlikumiem, izm…
Reactivity of the Superheavy Element 115, Mc, and Its Lighter Homologue, Bi, with Respect to Gold and Hydroxylated Quartz Surfaces from Periodic Rela…
2021
Adsorption energies (Eads) of the superheavy element (SHE) Mc, its lighter homologue (Bi), as well as of another superheavy element Nh and some lighter homologues of SHEs on gold and hydroxylated quartz surfaces are predicted via periodic relativistic density functional theory calculations. The aim of this study is to support "one-atom-at-a-time" gas-phase chromatography experiments that are examining the reactivity and volatility of Mc. The obtained Eads values of the Bi and Mc atoms on the Au(111) surface are >200 kJ/mol. On the hydroxylated quartz surface, Mc should adsorb with a minimal energy of 58 kJ/mol. On both types of surfaces, Eads(Mc) should be ∼100 kJ/mol smaller than Eads(Bi) …
Six-coordinate [CoIII(L)2]z (z = 1−, 0, 1+) complexes of an azo-appended o-aminophenolate in amidate(2−) and iminosemiquinonate π-radical (1−) redox-…
2018
Aerobic reaction of the ligand H2L1, 2-(2-phenylazo)-anilino-4,6-di-tert-butylphenol, CoCl2·6H2O and Et3N in MeOH under refluxing conditions produces, after work-up and recrystallization, black crystals of [Co(L1)2] (1). When examined by cyclic voltammetry, 1 displays in CH2Cl2 three one-electron redox responses: two oxidative, E11/2 = 0.30 V (peak-to-peak separation, ΔEp = 100 mV) and E21/2 = 1.04 V (ΔEp = 120 mV), and one reductive E1/2 = −0.27 V (ΔEp = 120 mV) vs. SCE. Consequently, 1 is chemically oxidized by 1 equiv. of [FeIII(η5-C5H5)2][PF6], affording the isolation of deep purple crystals of [Co(L1)2][PF6]·2CH2Cl2 (2), and one-electron reduction with [CoII(η5-C5H5)2] yielded bluish-b…
[CuII{(LISQ)˙−}2] (H2L: thioether-appended o-aminophenol ligand) monocation triggers change in donor site from N2O2 to N2O(2)S and valence-tautomerism
2019
Using a potentially tridentate o-aminophenol-based redox-active ligand H2L1 (2-[2-(benzylthio)phenylamino]-4,6-di-tert-butylphenol) in its deprotonated form, [Cu(L1)2] has been synthesized and crystallized as [CuII(L1)2]·CH2Cl2 (1·CH2Cl2). A cyclic voltammetry experiment (in CH2Cl2; V vs. SCE (saturated calomel electrode)) on 1·CH2Cl2 exhibits two oxidative (E = 0.20 V (peak-to-peak separation, ΔEp = 100 mV) and E = 0.90 V (ΔEp = 140 mV)) and two reductive (E = -0.52 V (ΔEp = 110 mV) and E = -0.92 V (ΔEp = 120 mV)) responses. Upon oxidation using a stoichiometric amount of [FeIII(η5-C5H5)2](PF6), 1·CH2Cl2 yielded [Cu(L1)2](PF6) (2). Structural analysis (100 K) reveals that 1·CH2Cl2 is a fou…
New light on an old debate: does the RCN–PtCl2 bond include any back-donation? RCN←PtCl2 backbonding vs. the IR νCN blue-shift dichotomy in organoni…
2019
For a series of organonitrile [RCN (R = Me, CF3, Ph, CH3Ph, CF3Ph)] ligands, the nature of the N–Pt bond in the related cis-/trans-(RCN)2PtCl2 complexes has been computationally investigated by Density Functional Theory. A fragment based bond analysis has been performed in the canonical Kohn–Sham molecular orbitals framework, and it has been ultimately assessed that this bond is characterized both by N→Pt σ and by N←Pt π contributions. Voronoi Deformation Density charges further confirms the occurrence of N←Pt π interactions. Moreover, the Energy Decomposition Analysis-Natural Orbital for Chemical Valence (EDA-NOCV) method shows that the strength of the N←Pt π interaction is not negligible …
Electronic and optical properties of CeO 2 from first principles calculations
2016
International audience; First-principles calculations of the electronic structure of CeO2 nanoparticles (NPs) were performed to investigate published experimental data obtained by different spectroscopies. The main features of the valence and conduction bands have been analyzed from the total and partial density of states. Several functionals were applied to interpret and quantify the optical properties, including the dielectric function, extinction coefficient and refractive index. It is found that the on-site hybrid functional B3PW91 modelled most suitably the band gap region of CeO2 NPs and consequently gave a more accurate band gap value. It also agreed very well with the experimental v…
Absolute acidity of clay edge sites from ab-initio simulations
2012
International audience; We provide a microscopic understanding of the solvation structure and reactivity of the edges of neutral clays. In particular we address the tendency to deprotonation of the different reactive groups on the (0 1 0) face of pyrophyllite. Such information cannot be inferred directly from titration experiments, which do not discriminate between different sites and whose interpretation resorts to macroscopic models. The determination of the corresponding pKa then usually relies on bond valence models, sometimes improved by incorporating some structural information from ab-initio simulations. Here we use density functional theory based molecular dynamics simulations, comb…