Energy function

In this paper, optimal MIQP models with two different objective functions to overcome the duck curve is introduced. The models are evaluated in the California power grid (CAISO), where the penetration of solar energy is significant.

9p visergeyne 18-06-2024 1 0   Download

In this work, we examine cross sections for (α, γ) reactions on p-nuclei, including 90Zr, 121Sb, 151Eu, and 162Er at astrophysically relevant energies. By using our recently developed α optical model potential (α-OMP), the (α, γ) cross sections were calculated within six models of radiative strength functions (RSF) which consisted of the microscopic HFB-QRPA model based on the BSk14 Skyrme force, the HF-BCS theory using Skyrme parameters, the EGLO model, SMLO model, the empirical SMLO (SMLOg) and global semi-microscopic (D1M-QRPAg) models.

7p viambani 18-06-2024 1 1   Download

Part 2 book "Electricity and electronics for renewable energy technology - An introduction" includes content: AC motors and generators; electric power transmission and distribution; electronic components, functions, and devices; diode; regulating diodes and applications; diode rectifiers and filters; transistor; transistor circuits; switchable diodes and gated transistors; power converters; electronic power converters in wind turbines and solar photovoltaic systems; digital electronics; logic circuits and applications; encoders and decoders.

455p dianmotminh01 20-05-2024 5 4   Download

Part 2 book "Energy harvesting with functional materials and microsystems" includes content: Polymer solar cell - an energy source for low power consumption electronics; inverted organic solar cells; monocrystalline silicon solar cell optimization and modeling; piezoelectric thin films and their application to vibration energy harvesters; piezoelectric vibration energy harvesters - modeling, design, limits, and benchmarking.

149p dianmotminh01 20-05-2024 3 2   Download

Part 1 book "Energy harvesting with functional materials and microsystems" includes content: Powering microsystems with ambient energy, low power energy harvesting solutions for biomedical devices, energy harvesting - thermoelectric and microsystems perspectives and opportunities; thermopower wave based micro and nanoscale energy sources.

143p dianmotminh01 20-05-2024 1 1   Download

The wave function regards like localized orbital locator, electron localized function, average localized ionization energy and non-covalent interaction are also examined as a means of theoretical evidence of the titled compound. The NBO calculations probe the intermolecular and intramolecular movement of charges, and additionally the molecule's stability. The ADMET properties are also considered for the compound with the assistance of Swiss ADMET online tool.

17p dianmotminh02 03-05-2024 1 1   Download

This global minimum structure has the shape of a tetragonal bipyramid having two Sc atoms at two tops of pyramids binding with one edge of Ge-Ge. The ground electronic state of the global minimum isomer is the 2B2 state in the C2v symmetry. The most stable isomer of Sc2Ge6 − has been used to study the CO adsorption. The calculated results indicate that the Sc2Ge6 − cluster has a good interaction with the CO molecule. The adsorption positions are around the Sc atom with two stable models include adsorbing the C atom and adsorbing both the C and O atoms of the CO molecule.

7p dianmotminh02 03-05-2024 2 1   Download

A thermochemical model was developed to calculate the H2 adsorption isotherm of the original Mg-MOF-74 framework, and its computationally designed isoreticular employing the adsorption energies and vibrational frequencies obtained from density functional theory calculations as input variables. The model reasonably replicates the experimental adsorption isotherm of the original framework at -196˚C within the pressure range up to 1 bar

13p dianmotminh02 03-05-2024 3 1   Download

The geometries and relative stabilities of 15 tautomeric forms and the corresponding isomers of the studied molecules have been identified and their relative stabilities are investigated. The potential energy profiles and intrinsic reaction coordinates (IRC) calculations along the proton transfer coordinates both in the ground and in the excited state are monitored as well. The impact of the donating (OMe) and withdrawing (NO2) groups on the single and double proton transfers are investigated both in the gas phase and solution.

9p dianmotminh02 03-05-2024 4 1   Download

The melting points of the complexes were >350oC, indicating high thermal stability. Cu-Zn-containing complex showed the least binding energy against the three proteins. The bioactivity scores of the complexes were between -0.50 and 0.0. Against A549 Cu-Zn, Co-Zn and Fe-Zn containing complexes showed potential activity. Against MCF-7, Fe-Cu containing complex had IC50 of 53.5 whereas Co-Zn containing complex was active against HepG2. Three complexes were active against S. aureus in the tested range.

18p dianmotminh02 03-05-2024 2 1   Download

This study focuses on examining the effect of the π bridge on the properties of the molecule. The structural parameters of the molecular geometry were optimized, the HOMO and LUMO energies were calculated and analyzed in detail. In addition, the absorption wavelength, excitation energy, vibration intensity and electron transfer were calculated through the time-dependent density functional theory (TD-DFT) method.

6p dianmotminh02 03-05-2024 4 2   Download

This article presents computational insights into the geometric and electronic structures of NbSi4 −/0 clusters using density functional theory and the CASSCF/CASPT2 method. The anionic and neutral ground states are identified as the 1A′ and 2A′ states, respectively, within a trigonal bipyramidal isomer where the Nb atom occupies the equatorial position. The adiabatic detachment energy for the transition from the anionic ground state 1A′ to the neutral ground state 2A′ is estimated to be 2.30 eV.

8p dianmotminh02 03-05-2024 4 2   Download

Three chalcones with a 2,3-dihydrobenzofuran linkage were analyzed by applying the density functional theory (DFT) and B3LYP approach with the 6-311G(d,p) basis set in this report. Spectroscopic and theoretical analyses were used to examine the structures of these three chalcones. The chalcone molecules' HOMO-LUMO energy was determined. Chemical reactivity parameters and molecular electrostatic surface potential (MESP) plots were obtained to gain useful insight into the distribution of charge density.

11p dianmotminh02 03-05-2024 3 2   Download

Ebook "Ultrasound technology in dairy processing" provides an overview of the use of ultrasound in various dairy applications, highlighting their significant benefits for the dairy industry, including energy savings and product improvement. It describes in detail the physical and chemical effects of high- and low-frequency power ultrasound in specific applications such as emulsification, ultrafiltration, crystallisation, inactivation of microbes, functionality modifications of secondary dairy products and fat separation.

46p tracanhphuonghoa1007 22-04-2024 7 3   Download

In ebook "Single-molecule fluorescence spectroscopy of the folding of a repeat protein" single-molecule fluorescence resonance energy transfer (FRET) spectroscopy was used to study the folding of a protein that belongs to the large and important family of repeat proteins. Cohen shows that the dynamics of the expanded conformations is likely to be very fast, suggesting a spring-like motion of the whole chain. The findings shed new light on the elasticity of structure in repeat proteins, which is related to their function in binding multiple and disparate partners.

70p tracanhphuonghoa1007 22-04-2024 4 3   Download

Ebook "Nanomaterials for fuel cell catalysis" provide an authoritative source of information on the use of electrochemical fuel cells, and in particular discuss the use of nanomaterials to enhance the performance of existing energy systems. The book covers the state of the art in the design, preparation, and engineering of nanoscale functional materials as effective catalysts for fuel cell chemistry, highlights recent progress in electrocatalysis at both fuel cell anode and cathode, and details perspectives and challenges in future research.

583p tracanhphuonghoa1007 22-04-2024 6 3   Download

Exercise training is well established as the most effective way to enhance muscle performance and muscle building. The composition of skeletal muscle fiber type affects systemic energy expenditures, and perturbations in metabolic homeostasis contribute to the onset of obesity and other metabolic dysfunctions.

21p vibransone 28-03-2024 3 2   Download

Ebook "Chemical science of π-electron systems" presents the most advanced review available of all aspects of π-electron systems, including novel structures, new synthetic protocols, chemical and physical properties, spectroscopic and computational insights, molecular engineering, device properties and physiological properties. π-Electron systems are ubiquitous in nature. Plants convert light energy into chemical energy by photosynthetic processes, in which chlorophylls and other porphyrinoids play an important role.

765p tudohanhtau1006 29-03-2024 3 1   Download

Ebook "Fluorescence in bio-inspired nanotechnology: First as probe, then as function" describes the evolving field of DNA nanotechnology in a lucid and easily accessible way. A central theme in the thesis is how biological structures and mechanisms constitute a basis for the design of novel technologies. Hannestad discusses how self-assembled, nanometer-scale DNA constructs can be functionalized using fluorescent labeling.

127p coduathanh1122 27-03-2024 3 1   Download

Ebook "Chemical thermodynamics: An introduction" provides a concise explanation of the key concepts and calculations of chemical thermodynamics. Instead of the usual ‘classical’ introduction, this text adopts a straightforward postulatory approach that introduces thermodynamic potentials such as entropy and energy more directly and transparently.

362p coduathanh1122 27-03-2024 2 1   Download