A Quantitative Picture of the Fringed Micellar Model of Cellulose

1971 ◽  
Vol 41 (8) ◽  
pp. 647-653 ◽  
Author(s):  
A. M. Scallan
Keyword(s):  
Acid Hydrolysis ◽  
Bacterial Cellulose ◽  
Deuterium Oxide ◽  
Tire Cord ◽  
X Ray Diffraction ◽  
Wood Cellulose ◽  
X Ray ◽  
Diffraction Patterns ◽  
Recent Interpretation

Quantitative diagrams of the fringed micellar model have been produced for tire cord, Fortisan, wood cellulose, cotton, ramie and bacterial cellulose, based on the results of the reactivities of these celluloses towards deuterium oxide and acid hydrolysis. The hypothesis has been used that rapid acid hydrolysis occurs in the truly amorphous zones, whereas deuteration occurs not only in these zones but also on the surfaces of the crystallites. It is from this hypothesis that calculations of crystallinity, crystallite width, and crystallite length have been made. The calculated fractional crystallinities of native celluloses are, therefore, in the range of 0.89-0.96, while those of regenerated celluloses range from 0.65 to 0.85. These crystallinities are higher than previously accepted values and are more in keeping with the most recent interpretation of x-ray diffraction patterns. The values of calculated crystallite width were about 17Å for the regenerated celluloses and 32Å for native celluloses. The latter value is close to that currently proposed by electron microscopists. Crystallite lengths were calculated from the levelling-off DP found on acid hydrolysis. The various methods of measuring crystallinity are discussed in terms of the model, as are microfibrils, crystallites, and paracrystalline cellulose.

scholarly journals Nitrogen, Phosphorus and Sulfur Co-Doped Pyrolyzed Bacterial Cellulose Nanofibers for Supercapacitors

Nanomaterials ◽  
2020 ◽  
Vol 10 (10) ◽  
pp. 1912
Author(s):  
Zheng Li ◽  
Yaogang Wang ◽  
Wen Xia ◽  
Jixian Gong ◽  
Shiru Jia ◽  
...  
Keyword(s):  
Bacterial Cellulose ◽  
High Performance ◽  
Electrode Materials ◽  
Cellulose Nanofibers ◽  
Electrochemical Performances ◽  
X Ray Diffraction ◽  
X Ray ◽  
Diffraction Patterns ◽  
Nitrogen Phosphorus ◽  
Co Doped

Heteroatom doping is an effective way to raise the electrochemical properties of carbon materials. In this paper, a novel electrode material including nitrogen, phosphorus, and sulfur co-doped pyrolyzed bacterial cellulose (N/P/S-PBC) nanofibers was produced. The morphologies, structure characteristics and electrochemical performances of the materials were investigated by Scanning electron microscopy, Fourier transform infrared spectra, X-ray diffraction patterns, X-ray photoelectronic spectroscopy, N2 sorption analysis and electrochemical measurements. When 3.9 atom% of nitrogen, 1.22 atom% of phosphorus and 0.6 atom% of sulfur co-doped into PBC, the specific capacitance of N/P/S-PBC at 1.0 A/g was 255 F/g and the N/P/S-PBC supercapacitors’ energy density at 1 A/g was 8.48 Wh/kg with a power density of 489.45 W/kg, which were better than those of the N/P-PBC and N/S-PBC supercapacitors. This material may be a very good candidate as the promising electrode materials for high-performance supercapacitors.

scholarly journals Synthesis of Platinum Nanoparticles from K2PtCl4 Solution Using Bacterial Cellulose Matrix

2014 ◽  
Vol 2014 ◽  
pp. 1-6 ◽  
Author(s):  
H. F. Aritonang ◽  
D. Onggo ◽  
C. Ciptati ◽  
C. L. Radiman
Keyword(s):  
Bacterial Cellulose ◽  
Pt Nanoparticles ◽  
Precursor Solution ◽  
Hydrogen Gas ◽  
Precursor Concentration ◽  
X Ray Diffraction ◽  
X Ray ◽  
Potassium Tetrachloroplatinate ◽  
Diffraction Patterns ◽  
Tga Analysis

Platinum (Pt) nanoparticles have been synthesized from a precursor solution of potassium tetrachloroplatinate (K2PtCl4) using a matrix of bacterial cellulose (BC). The formation of Pt nanoparticles occurs at the surface and the inside of the BC membrane by reducing the precursor solution with a hydrogen gas reductant. The Pt nanoparticles obtained from the variations of precursor concentration, between 3 mM and 30 mM, and the formation of Pt nanoparticles have been studied using X-ray diffraction (XRD), scanning electron microscopy-energy dispersive X-ray spectroscopy (SEM-EDS), and thermogravimetry analysis (TGA). Based on X-ray diffraction patterns, Pt particles have sizes between 6.3 nm and 9.3 nm, and the Pt particle size increases with an increase in precursor concentration. The morphology of the Pt nanoparticles was observed by SEM-EDS and the content of Pt particles inside the membrane is higher than that on the surface of BC membranes. This analysis corresponds to the TGA analysis, but the TGA analysis is more representative in how it describes the content of Pt particles in the BC membrane.

X-Ray Diffraction Patterns of Oil Palm Empty Fruit Bunch Fibers with Varying Crystallinity

2015 ◽  
Vol 1087 ◽  
pp. 321-328 ◽  
Author(s):  
Fatin Afifah Ahmad Kuthi ◽  
Khairiah Haji Badri ◽  
Azlin Mohmad Azman
Keyword(s):  
Acid Hydrolysis ◽  
Oil Palm ◽  
Empty Fruit Bunch ◽  
X Ray Diffraction ◽  
Xrd Pattern ◽  
X Ray ◽  
Before And After ◽  
Different Temperatures ◽  
Diffraction Patterns ◽  
Xrd Patterns

Crystallinity of oil palm fiber from empty fruit bunch (EFB) with and without tretaments was studied by analyzing the X-ray diffraction (XRD) pattern. In this paper, we focused on the effect of acid hydrolysis onto EFB on the crystallinity of the extracted cellulose. The reaction was carried out by soaking EFB in 1% (v/v) aqueous sulfuric acid (H2SO4) at different temperatures of 120, 130 and 140°C for 1 h. The XRD patterns significantly showed changes in the 2θ peaks before and after the treatment. These changes were described in term of polymorphs type present, reflection and allomorphs of the samples. XRD peak high and XRD deconvolution methods were used to calculate and compare the percentage of crystallinity of untreated EFB (UT-EFB) and acid hydrolyzed samples (AH-EFB). Based on the calculation, increment of about 1.3 times and 1.5 times were achieved by using WAXS and XRD deconvolution methods respectively. This is due to the removal of amorphous part contributed by lignin, hemicellulose and cellulose. Fourier Transform infrared (FTIR) spectra showed the presence of similar peaks in AH-EFB and commercial microcrystalline cellulose (C-MCC) at 1427, 1315, 895 and 1022 cm-1. The micrographic features showed the acid hydrolysis had successfully took place and separated the EFB microfibrils bundles.

Evaluation of Freezing Methods by Low Temperature X-Ray Diffraction

1977 ◽  
Vol 35 ◽  
pp. 330-333
Author(s):  
T. Gulik-Krzywicki ◽  
M.J. Costello
Keyword(s):  
Biological Materials ◽  
Molecular Organization ◽  
X Ray Diffraction ◽  
Glass Capillary ◽  
X Ray ◽  
Rate Dependent ◽  
Before And After ◽  
Freeze Etching ◽  
Diffraction Patterns ◽  
Set Up

Freeze-etching electron microscopy is currently one of the best methods for studying molecular organization of biological materials. Its application, however, is still limited by our imprecise knowledge about the perturbations of the original organization which may occur during quenching and fracturing of the samples and during the replication of fractured surfaces. Although it is well known that the preservation of the molecular organization of biological materials is critically dependent on the rate of freezing of the samples, little information is presently available concerning the nature and the extent of freezing-rate dependent perturbations of the original organizations. In order to obtain this information, we have developed a method based on the comparison of x-ray diffraction patterns of samples before and after freezing, prior to fracturing and replication.Our experimental set-up is shown in Fig. 1. The sample to be quenched is placed on its holder which is then mounted on a small metal holder (O) fixed on a glass capillary (p), whose position is controlled by a micromanipulator.

Examination of Rabbit Fc Crystals

1968 ◽  
Vol 26 ◽  
pp. 140-141
Author(s):  
J. P. Robinson ◽  
P. G. Lenhert
Keyword(s):  
Molecular Weight ◽  
Flat Plate ◽  
Phosphate Buffer ◽  
Asymmetric Unit ◽  
X Ray Diffraction ◽  
X Ray ◽  
Neutral Ph ◽  
Small Crystals ◽  
Carbon Coated ◽  
Diffraction Patterns

Crystallographic studies of rabbit Fc using X-ray diffraction patterns were recently reported. The unit cell constants were reported to be a = 69. 2 A°, b = 73. 1 A°, c = 60. 6 A°, B = 104° 30', space group P21, monoclinic, volume of asymmetric unit V = 148, 000 A°3. The molecular weight of the fragment was determined to be 55, 000 ± 2000 which is in agreement with earlier determinations by other methods.Fc crystals were formed in water or dilute phosphate buffer at neutral pH. The resulting crystal was a flat plate as previously described. Preparations of small crystals were negatively stained by mixing the suspension with equal volumes of 2% silicotungstate at neutral pH. A drop of the mixture was placed on a carbon coated grid and allowed to stand for a few minutes. The excess liquid was removed and the grid was immediately put in the microscope.

Control of the phase composition of advanced calcium phosphates using an x-ray diffractometer with a curved position-sensitive detector

2020 ◽  
Vol 86 (6) ◽  
pp. 29-35
Author(s):  
V. P. Sirotinkin ◽  
O. V. Baranov ◽  
A. Yu. Fedotov ◽  
S. M. Barinov
Keyword(s):  
Phase Composition ◽  
Calcium Phosphates ◽  
Position Sensitive Detector ◽  
Sensitive Detector ◽  
X Ray Diffraction ◽  
X Ray ◽  
Impurity Phases ◽  
Position Sensitive ◽  
Diffraction Peaks ◽  
Diffraction Patterns

The results of studying the phase composition of advanced calcium phosphates Ca10(PO4)6(OH)2, β-Ca3(PO4)2, α-Ca3(PO4)2, CaHPO4 · 2H2O, Ca8(HPO4)2(PO4)4 · 5H2O using an x-ray diffractometer with a curved position-sensitive detector are presented. Optimal experimental conditions (angular positions of the x-ray tube and detector, size of the slits, exposure time) were determined with allowance for possible formation of the impurity phases during synthesis. The construction features of diffractometers with a position-sensitive detector affecting the profile characteristics of x-ray diffraction peaks are considered. The composition for calibration of the diffractometer (a mixture of sodium acetate and yttrium oxide) was determined. Theoretical x-ray diffraction patterns for corresponding calcium phosphates are constructed on the basis of the literature data. These x-ray diffraction patterns were used to determine the phase composition of the advanced calcium phosphates. The features of advanced calcium phosphates, which should be taken into account during the phase analysis, are indicated. The powder of high-temperature form of tricalcium phosphate strongly adsorbs water from the environment. A strong texture is observed on the x-ray diffraction spectra of dicalcium phosphate dihydrate. A rather specific x-ray diffraction pattern of octacalcium phosphate pentahydrate revealed the only one strong peak at small angles. In all cases, significant deviations are observed for the recorded angular positions and relative intensity of the diffraction peaks. The results of the study of experimentally obtained mixtures of calcium phosphate are presented. It is shown that the graphic comparison of experimental x-ray diffraction spectra and pre-recorded spectra of the reference calcium phosphates and possible impurity phases is the most effective method. In this case, there is no need for calibration. When using this method, the total time for analysis of one sample is no more than 10 min.

Infrared spectroscopic study of the YPO4-YCrO4 system

1985 ◽  
Vol 50 (10) ◽  
pp. 2139-2145
Author(s):  
Alexander Muck ◽  
Eva Šantavá ◽  
Bohumil Hájek
Keyword(s):  
Spectroscopic Study ◽  
Infrared Spectra ◽  
Point Of View ◽  
Mixed Crystals ◽  
Crystal Symmetry ◽  
Infrared Spectroscopic Study ◽  
X Ray Diffraction ◽  
X Ray ◽  
Infrared Spectroscopic ◽  
Diffraction Patterns

The infrared spectra and powder X-ray diffraction patterns of polycrystalline YPO4-YCrO4 samples are studied from the point of view of their crystal symmetry. Mixed crystals of the D4h19 symmetry are formed over the region of 0-30 mol.% YPO4 in YCrO4. The Td → D2d → D2 or C2v(GS eff) correlation is appropriate for both PO43- and CrO43- anions.

scholarly journals Deep learning for visualization and novelty detection in large X-ray diffraction datasets

2021 ◽  
Vol 7 (1) ◽  
Author(s):  
Lars Banko ◽  
Phillip M. Maffettone ◽  
Dennis Naujoks ◽  
Daniel Olds ◽  
Alfred Ludwig
Keyword(s):  
Thin Film ◽  
Crystal Structure ◽  
Artificial Intelligence ◽  
Deep Learning ◽  
Novelty Detection ◽  
Structural Similarity ◽  
X Ray Diffraction ◽  
X Ray ◽  
Diffraction Patterns ◽  
Post Hoc

AbstractWe apply variational autoencoders (VAE) to X-ray diffraction (XRD) data analysis on both simulated and experimental thin-film data. We show that crystal structure representations learned by a VAE reveal latent information, such as the structural similarity of textured diffraction patterns. While other artificial intelligence (AI) agents are effective at classifying XRD data into known phases, a similarly conditioned VAE is uniquely effective at knowing what it doesn’t know: it can rapidly identify data outside the distribution it was trained on, such as novel phases and mixtures. These capabilities demonstrate that a VAE is a valuable AI agent for aiding materials discovery and understanding XRD measurements both ‘on-the-fly’ and during post hoc analysis.

scholarly journals Simultaneous Multi-Bragg Peak Coherent X-ray Diffraction Imaging

Crystals ◽  
2021 ◽  
Vol 11 (3) ◽  
pp. 312
Author(s):  
Florian Lauraux ◽  
Stéphane Labat ◽  
Sarah Yehya ◽  
Marie-Ingrid Richard ◽  
Steven J. Leake ◽  
...  
Keyword(s):  
Bragg Reflection ◽  
Volume Ratio ◽  
X Ray Diffraction ◽  
X Ray ◽  
Crystal Substrate ◽  
In Series ◽  
Diffraction Imaging ◽  
Diffraction Patterns ◽  
Lattice Planes ◽  
Oriented Parallel

The simultaneous measurement of two Bragg reflections by Bragg coherent X-ray diffraction is demonstrated on a twinned Au crystal, which was prepared by the solid-state dewetting of a 30 nm thin gold film on a sapphire substrate. The crystal was oriented on a goniometer so that two lattice planes fulfill the Bragg condition at the same time. The Au 111 and Au 200 Bragg peaks were measured simultaneously by scanning the energy of the incident X-ray beam and recording the diffraction patterns with two two-dimensional detectors. While the former Bragg reflection is not sensitive to the twin boundary, which is oriented parallel to the crystal–substrate interface, the latter reflection is only sensitive to one part of the crystal. The volume ratio between the two parts of the twinned crystal is about 1:9, which is also confirmed by Laue microdiffraction of the same crystal. The parallel measurement of multiple Bragg reflections is essential for future in situ and operando studies, which are so far limited to either a single Bragg reflection or several in series, to facilitate the precise monitoring of both the strain field and defects during the application of external stimuli.

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