scholarly journals Manganese oxides synthesized via microwave-assisted hydrothermal method: phase evolution and structure refinement

2020 ◽  
Author(s):  
Roumanos G. D. Neto ◽  
Wagner Costa Macedo ◽  
José D. Fernandes ◽  
Agda E. S. Albas ◽  
Silvio R. Teixeira ◽  
...  
Keyword(s):  
Manganese Oxides ◽  
Rietveld Method ◽  
Structural Characteristics ◽  
Structure Refinement ◽  
Average Crystallite Size ◽  
Phase Evolution ◽  
Microwave Assisted ◽  
Heat Treated ◽  
Different Temperatures ◽  
Major Variation

Abstract Manganese oxides were synthesized during 40 min at 140 ºC via Microwave-Assisted Hydrothermal (MAH) method and treated at different temperatures in order to evaluate the phase evolution using structure refinement (Rietveld method). The samples obtained were heat treated at temperatures defined by means of thermal analysis (160 ºC, 480 ºC, 715 ºC, 870 ºC, 920 ºC and 1150 ºC) and analyzed by XRD, XRF, FTIR spectroscopy, Raman scattering and SEM. Structural characterizations allowed to identify five distinct phases: α-MnO2, Mn3O4, Mn5O8, Na2Mn5O10 and Na4Mn9O18 with weight percentages dependent on the heat treatment. The hausmannite structure (average crystallite size ranging from 28.9 nm to 99.1 nm) is present in all samples and go through various oxidation and reduction processes from 160 ºC to 1150 ºC without any major variation in the lattice parameters. The results presented enables a better interpretation of the thermal and structural characteristics of manganese oxides synthesized via MAH.

Nanomaterial Preparations by Microwave-Assisted Solution Combustion Method and Material Properties of SnO2 Powder - A Status Review

2011 ◽  
Vol 671 ◽  
pp. 69-120 ◽  
Author(s):  
L.C. Nehru ◽  
V. Swaminathan ◽  
M. Jayachandran ◽  
C. Sanjeeviraja
Keyword(s):  
Structural Parameters ◽  
Combustion Process ◽  
Average Crystallite Size ◽  
Combustion Method ◽  
Solution Combustion ◽  
Xrd Pattern ◽  
Microwave Assisted ◽  
Heat Treated ◽  
Sno2 Sample ◽  
Crystal Density

A nanocrystalline tin oxide (SnO2) powders have been prepared by a simple, low-temperature initiated, self-propagating and gas producing by microwave-assisted solution combustion process. The effects of temperature on crystalline phase formation and particle size of nanocrystalline SnO2 and its structure have been investigated. It is observed that heat-treated upto 800°C shows tetragonal phase SnO2. It was observed that the average crystallite size of the annealed SnO2 samples is in the range 9 - 43 nm through controlled heat treatment process. The crystal density of the as-prepared powder is 5.850g cm-3 where as the bulk density is 6.998 g cm−3. The microstructure and morphology were studied by scanning electron microscope (SEM) and HRTEM it is interesting to note that as-prepared SnO2 sample are almost spherical in shape and average agglomerate crystal size of 0.2 – 0.4 μm with increase in calcination temperature, the samples become better morphology than the as-prepared sample. The crystallographic parameters were refined by XRD pattern and Rietveld refinement using TOPAS-3 and Diamond software was used to construct the structural parameters.

Experimental and Theoretical (ab initio and DFT) Analysis of UV-Vis Spectra, Thermodynamic Functions and Non-linear Optical Properties of 2-Chloro-3,4-Dimethoxybenzaldehyde

2015 ◽  
Vol 8 (2) ◽  
pp. 2122-2134
Author(s):  
Sarvendra Kumar ◽  
Rajesh Kumar ◽  
Jayant Teotia ◽  
M. K. Yadav
Keyword(s):  
Thermodynamic Functions ◽  
Title Compound ◽  
Density Functional ◽  
Structural Characteristics ◽  
Basis Sets ◽  
Ultraviolet Absorption Spectrum ◽  
Non Linear ◽  
Different Temperatures ◽  
Linear Optical Properties ◽  
Linear Optical

In the present work, UV- Visible spectra of 2-Chloro-3,4-Dimethoxybenzaldehyde (2,3,4-CDMB) compound  have been carried out experimentally and theoretically. The ultraviolet absorption spectrum of title compound in three solvents (Acetone, Diethyl Ether, CCl4) of different polarity were examined in the range of 200–500 nm. The structure of the molecule was optimized and the structural characteristics were determined by HF and DFT (B3LYP) methods with 6-31+G(d,p) and 6-311++G(d,p) as basis sets. The excitation energy, wavelength corresponds to absorption maxima () and oscillator strength (f) are calculated by Time-Dependent Density Functional Theory (TD-DFT) using B3LYP/6-31+G(d,p) and B3LYP/6-311++G(d,p) as basis sets. The electric dipole moment (μ), polarizability (α) and the first hyperpolarizability (β ) have been computed to evaluate the non-linear optical (NLO) response of the investigated compound by HF and DFT (B3LYP) with already mentioned basis sets. Thermodynamic functions of the title compound at different temperatures were also calculated.

Heat Treatment Influence on the Corrosion Resistance of a Cu-Al-Fe-Mn Bronze

2018 ◽  
Vol 69 (5) ◽  
pp. 1055-1059 ◽  
Author(s):  
Mariana Ciurdas ◽  
Ioana Arina Gherghescu ◽  
Sorin Ciuca ◽  
Alina Daniela Necsulescu ◽  
Cosmin Cotrut ◽  
...  
Keyword(s):  
Heat Treatment ◽  
Corrosion Resistance ◽  
Structural Changes ◽  
Heating Temperature ◽  
Galvanic Corrosion ◽  
Cooling Water ◽  
Open Circuit ◽  
Water Quenching ◽  
Heat Treated ◽  
Different Temperatures

Aluminium bronzes are exhibiting good corrosion resistance in saline environments combined with high mechanical properties. Their corrosion resistance is obviously confered by the alloy chemical composition, but it can also be improved by heat treatment structural changes. In the present paper, five Cu-Al-Fe-Mn bronze samples were subjected to annealing heat treatments with furnace cooling, water quenching and water quenching followed by tempering at three different temperatures: 200, 400 and 550�C. The heating temperature on annealing and quenching was 900�C. The structure of the heat treated samples was studied by optical and scanning electron microscopy. Subsequently, the five samples were submitted to corrosion tests. The best resistance to galvanic corrosion was showed by the quenched sample, but it can be said that all samples are characterized by close values of open-circuit potentials and corrosion potentials. Concerning the susceptibility to other types of corrosion (selective leaching, pitting, crevice corrosion), the best corrosion resistant structure consists of a solid solution, g2 and k compounds, corresponding to the quenched and 550�C tempered sample.

scholarly journals Prediction of Thiol Group Changes in Minced Raw and Cooked Chicken Meat with Plant Extracts—Kinetic and Neural Network Approaches

Animals ◽  
2021 ◽  
Vol 11 (6) ◽  
pp. 1647
Author(s):  
Anna Kaczmarek ◽  
Małgorzata Muzolf-Panek
Keyword(s):  
Plant Extracts ◽  
Predictive Models ◽  
External Validation ◽  
Thiol Group ◽  
Chicken Meat ◽  
Validation Dataset ◽  
Heat Treated ◽  
Different Temperatures ◽  
Meat Samples ◽  
Network Approaches

The aim of the study was to develop predictive models of thiol group (SH) level changes in minced raw and heat-treated chicken meat enriched with selected plant extracts (allspice, basil, bay leaf, black seed, cardamom, caraway, cloves, garlic, nutmeg, onion, oregano, rosemary, and thyme) during storage at different temperatures. Meat samples with extract addition were stored under various temperatures (4, 8, 12, 16, and 20 °C). SH changes were measured spectrophotometrically using Ellman’s reagent. Samples stored at 12 °C were used as the external validation dataset. SH content decreased with storage time and temperature. The dependence of SH changes on temperature was adequately modeled by the Arrhenius equation with average high R2 coefficients for raw meat (R2 = 0.951) and heat-treated meat (R2 = 0.968). Kinetic models and artificial neural networks (ANNs) were used to build the predictive models of thiol group decay during meat storage. The obtained results demonstrate that both kinetic Arrhenius (R2 = 0.853 and 0.872 for raw and cooked meat, respectively) and ANN (R2 = 0.803) models can predict thiol group changes in raw and cooked ground chicken meat during storage.

scholarly journals Effect of Powder Heat Treatment on Chemical Composition and Thermoelectric Properties of Bismuth Antimony Telluride Alloys Fabricated by Combining Water Atomization and Spark Plasma Sintering

Materials ◽  
2021 ◽  
Vol 14 (11) ◽  
pp. 2993
Author(s):  
Dong-won Shin ◽  
Peyala Dharmaiah ◽  
Jun-Woo Song ◽  
Soon-Jik Hong
Keyword(s):  
Spark Plasma Sintering ◽  
Thermoelectric Properties ◽  
Hole Concentration ◽  
Bismuth Antimony Telluride ◽  
Plasma Sintering ◽  
Heat Treated ◽  
Water Atomization ◽  
Powder Samples ◽  
Different Temperatures ◽  
Spark Plasma

In this work, Bi0.5Sb1.5Te3 materials were produced by an economically viable and time efficient water atomization process. The powder samples were heat treated at different temperatures (673 K, 723 K, 743 K, 773 K, 803 K, and 823 K) followed by spark plasma sintering (SPS). It was found that the Te evaporated slightly at 723 K and 743 K and became dominated at 773 K, 803 K, and 823 K, which severely influences the thermoelectric properties. The electrical conductivity was significantly improved for over 803 K heat treated samples due to the remarkable improvement in hole concentration. The power factor values for the 803 K and 823 K samples were significantly larger at T > 350 K compared to other samples. Consequently, the peak ZT of 0.92 at 350 K was obtained for the 803 K sample, which could be useful in commercial thermoelectric power generation.

Elasto-plastic deformation of glass-like carbons heat-treated at different temperatures

Carbon ◽  
2001 ◽  
Vol 39 (10) ◽  
pp. 1525-1532 ◽  
Author(s):  
Norio Iwashita ◽  
Michael V. Swain ◽  
John S. Field ◽  
Naoto Ohta ◽  
Shingo Bitoh
Keyword(s):  
Plastic Deformation ◽  
Heat Treated ◽  
Different Temperatures

Rietveld refinement of the solid-solution series: (Cu,Mg)SO4·H2O

1995 ◽  
Vol 10 (3) ◽  
pp. 189-194 ◽  
Author(s):  
C. L. Lengauer ◽  
G. Giester
Keyword(s):  
Solid Solution ◽  
Rietveld Refinement ◽  
Powder Diffraction ◽  
Rietveld Method ◽  
Structure Refinement ◽  
Solid Solution Series ◽  
Cation Site ◽  
Tg Analysis ◽  
X Ray ◽  
Solution Series

The kieserite-type solid-solution series of synthetic (Cu,Mg)SO4·H2O was investigated by TG-analysis and X-ray powder diffraction using the Rietveld method. Representatives with Cu≥20 mol% are triclinic distorted () analogous to the poitevinite (Cu,Fe)SO4·H2O compounds. Cation site ordering with preference of Cu for the more distorted M1 site was additionally proven by the structure refinement.

Formation of Grain Structures of Thermal Sprayed Nickel Coatings and the Coating Properties

2005 ◽  
Vol 502 ◽  
pp. 517-0
Author(s):  
Kenji Murakami
Keyword(s):  
Steel Substrate ◽  
Nickel Coatings ◽  
Grain Structures ◽  
Heat Treated ◽  
Columnar Grains ◽  
Different Temperatures ◽  
Plasma Sprayed ◽  
Equiaxed Grains ◽  
Sprayed Coatings ◽  
Lamellar Interfaces

Pure nickel powder was low pressure plasma sprayed onto a steel substrate held at different temperatures during spraying. The as-sprayed coatings consist of columnar grains whose axes are nearly perpendicular to the lamellae composing the coatings. As the coating temperature becomes higher, the length of the columnar grains increases and is longer than the thickness of the lamellae, indicating the growth of the grains across the lamellar interfaces during spraying. On the other hand, the coatings that were heat treated after spraying consist of coarse equiaxed grains. The coatings that experienced high temperatures during spraying or the heat treated coatings have large porosity and contain large globular pores. The hardness, apparent density and the tensile strength of the coating itself were the highest for the coating prepared at a low temperature and became low on heat treatment. The thermal conductivity in the direction perpendicular to the coating was the largest for the coating that consisted of long columnar grains.

Crystal structure of potassium tetraperoxomolybdate (VI) K2[Mo(O2)4]

2005 ◽  
Vol 20 (3) ◽  
pp. 203-206 ◽  
Author(s):  
M. Grzywa ◽  
M. Różycka ◽  
W. Łasocha
Keyword(s):  
Crystal Structure ◽  
Low Temperature ◽  
Diffraction Pattern ◽  
Powder Diffraction ◽  
Rietveld Method ◽  
Structure Refinement ◽  
Crystal Structure Refinement ◽  
Unit Cell Parameters ◽  
X Ray ◽  
Cell Parameters

Potassium tetraperoxomolybdate (VI) K2[Mo(O2)4] was prepared, and its X-ray powder diffraction pattern was recorded at low temperature (258 K). The unit cell parameters were refined to a=10.7891(2) Å, α=64.925(3)°, space group R−3c (167), Z=6. The compound is isostructural with potassium tetraperoxotungstate (VI) K2[W(O2)4] (Stomberg, 1988). The sample of K2[Mo(O2)4] was characterized by analytical investigations, and the results of crystal structure refinement by Rietveld method are presented; final RP and RWP are 9.79% and 12.37%, respectively.

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