phase transition Dotaz Zobrazit nápovědu
Our study demonstrates that nanoplasmonic sensing (NPS) can be utilized for the determination of the phase transition temperature (Tm) of phospholipids. During the phase transition, the lipid bilayer undergoes a conformational change. Therefore, it is presumed that the Tm of phospholipids can be determined by detecting conformational changes in liposomes. The studied lipids included 1,2-dipalmitoyl-sn-glycero-3-phosphocholine (DPPC), 1,2-dimyristoyl-sn-glycero-3-phosphocholine (DMPC), and 1,2-distearoyl-sn-glycero-3-phosphocholine (DSPC). Liposomes in gel phase are immobilized onto silicon dioxide sensors and the sensor cell temperature is increased until passing the Tm of the lipid. The results show that, when the system temperature approaches the Tm, a drop of the NPS signal is observed. The breakpoints in the temperatures are 22.5 °C, 41.0 °C, and 55.5 °C for DMPC, DPPC, and DSPC, respectively. These values are very close to the theoretical Tm values, i.e., 24 °C, 41.4 °C, and 55 °C for DMPC, DPPC, and DSPC, respectively. Our studies prove that the NPS methodology is a simple and valuable tool for the determination of the Tm of phospholipids.
- MeSH
- fosfolipidy chemie MeSH
- liposomy chemie MeSH
- povrchová plasmonová rezonance metody MeSH
- tranzitní teplota * MeSH
- změna skupenství * MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- Názvy látek
- fosfolipidy MeSH
- liposomy MeSH
The seminal paper by Zhirnov (1958 Zh. Eksp. Teor. Fiz. 35 1175-80) explained why the structure of domain walls in ferroelectrics and ferromagnets is drastically different. Here we show that the antiparallel ferroelectric walls in rhombohedral ferroelectric BaTiO(3) can be switched between the Ising-like state (typical for ferroelectrics) and a Bloch-like state (unusual for ferroelectric walls but typical for magnetic ones). Phase-field simulations using a Ginzburg-Landau-Devonshire model suggest that this symmetry-breaking transition can be induced by a compressive epitaxial stress. The strain-tunable chiral properties of these domain walls promise a range of novel phenomena in epitaxial ferroelectric thin films.
- MeSH
- chemické modely * MeSH
- magnetické pole MeSH
- mechanický stres MeSH
- molekulární modely * MeSH
- počítačová simulace MeSH
- sloučeniny barya chemie MeSH
- titan chemie MeSH
- změna skupenství MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- Názvy látek
- barium titanate(IV) MeSH Prohlížeč
- sloučeniny barya MeSH
- titan MeSH
The history of volume phase transition of responsive gels from its theoretical prediction to experimental discovery was described and the major role of mixing Gibbs energy function in theoretical models was stressed. For detailed analysis and fine tuning of the volume phase transition, the generalized Flory-Huggins model with concentration and temperature dependent interaction function coupled with Maxwell construction as a tool is very suitable. Application of expansive stresses can uncover the potential of various swelling gels for volume phase transition. Experimentally, the abrupt, equilibrium-controlled phase transition is often hard to achieve due to passage of gel through states of mechanical instability and slow relaxation processes in macroscopic objects.
- Klíčová slova
- Gibbs energy, cross-linking, gel, phase separation, polymer network, stimuli-responsive, swelling, volume phase transition,
- Publikační typ
- časopisecké články MeSH
- přehledy MeSH
A thermodynamic model is proposed describing swelling changes and swelling transitions of hybrid gels in which domains of folded chains are chemically built in as cross-links. These folded domains can be unfolded to random coils by osmotic forces produced by the synthetic gel matrix. Uncoiling takes place if the osmotic force acting on the cross-links exceeds the critical value. By unfolding, a new interacting surface is exposed to interactions and affects the swelling pressure. The chains of the folded domains may have ionized groups. The model is based on mean-field statistical-thermodynamic treatment of swelling of polyelectrolyte gels with finite extensibility of network chains. This study is related to hybrid hydrogels with built in protein motifs. A continuous change in external variables increasing the degree of swelling of the hydrogel brings about an abrupt increase in volume (transition) of the gel. The position and magnitude of the transition depend on structural parameters of the hybrid gel, such as fraction of the folded domains in the gel, degree of ionization of chains in the domain, presence of additional chemical cross-links, or degree of dilution at gel formation. Two options for reversibility of the changes are considered: (a) unfolding is irreversible and deswelling proceeds along other curve than swelling and (b) swelling is reversible when the osmotic force decrease below the critical value. In the latter case, swelling changes are described by a closed loop with two transitions. Under certain conditions (high dilution at network formation and sufficiently high degree of ionization of chains of the folded domains), a transition appears known as the collapse transition induced by balance of hydrophobic and hydrophillic interactions. This collapse transition induces the folding transition by which the folded domains are reformed.
- MeSH
- absorpce MeSH
- biopolymery chemie MeSH
- gely MeSH
- molekulární struktura MeSH
- polymery chemie MeSH
- reagencia zkříženě vázaná chemie MeSH
- termodynamika MeSH
- tlak MeSH
- voda MeSH
- změna skupenství * MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
- Názvy látek
- biopolymery MeSH
- gely MeSH
- polymery MeSH
- reagencia zkříženě vázaná MeSH
- voda MeSH
The possibilities of in situ spectroscopic ellipsometry applied to phase transitions investigation in oxide thin films and crystals are examined in this work, along with the use of various parameters calculated from ellipsometric data (band gap energy Eg, refractive index n and surface roughness) together with the directly measured main ellipsometric angles psi and Delta, for the detection of phase transitions. The efficiency of spectroscopic ellipsometry on "surface" phase transition and its sensitivity to surface defects are also demonstrated.
One of the emerging water desalination techniques relies on the compression of a polyelectrolyte gel. The pressures needed reach tens of bars, which are too high for many applications, damage the gel and prevent its reuse. Here, we study the process by means of coarse-grained simulations of hydrophobic weak polyelectrolyte gels and show that the necessary pressures can be lowered to only a few bars. We show that the dependence of applied pressure on the gel density contains a plateau indicating a phase separation. The phase separation was also confirmed by an analytical mean-field theory. The results of our study show that changes in the pH or salinity can induce the phase transition in the gel. We also found that ionization of the gel enhances its ion capacity, whereas increasing the gel hydrophobicity lowers the pressure required for gel compression. Therefore, combining both strategies enables the optimization of polyelectrolyte gel compression for water desalination purposes.
- Klíčová slova
- desalination, hydrophobic gels, polyelectrolyte hydrogels, simulations, volume-phase transition, weak polyelectrolytes,
- Publikační typ
- časopisecké články MeSH
Complex NH4[VO(O2)2(NH3)] (1) undergoes an order-disorder phase transition at Tc~258K. This transition is accompanied by change in the space group of the orthorhombic lattice and also by significant structural rearrangements of the constituent molecules, which are pertinent mostly to their NH4+ ions and their ammonia ligands. The low-temperature solid state IR and Raman spectra of 1 were corroborated by solid-state computations that employed Gaussian functions as the basis set. Results of these computations yielded excellent agreement with experimental data. On the curves of temperature dependence of vibrational modes, the phase transition is expressed by an abrupt change of the slope above Tc.
- Klíčová slova
- Crystal structure, Peroxido complex, Phase transition, Solid-state computation, Vibrational spectra,
- Publikační typ
- časopisecké články MeSH
The construction and maintenance of building stock is responsible for approximately 36% of all CO2 emissions in the European Union. One of the possibilities of how to achieve high energy-efficient and decarbonized building stock is the integration of renewable energy sources (RES) in building energy systems that contain efficient energy storage capacity. Phase Change Materials (PCMs) are latent heat storage media with a high potential of integration in building structures and technical systems. Their solid-liquid transition is specifically utilized for thermal energy storage in building applications. The typically quite old example is the use of ice that serves as long-term storage of cold. Large pieces of ice cut in winter were stored in heavily insulated spaces and prepared for cooling of food or beverages in summer. In the contemporary use of the principle, the PCMs for building applications and tested in this study must have a melting range close to the desired temperature in the occupied rooms. As the PCMs need to be encapsulated, several types of metal containers have been developed and tested for their thermal conductivity and resistance to mechanical damage, which enhances the performance of these so-called latent heat thermal energy storage (LHTES) systems. Long-term compatibility of metals with PCMs depends, i.e., on the elimination of an undesirable interaction between the metal and the specific PCM. Heat storage medium must be reliably sealed in a metal container, especially if the LHTES is integrated into systems where PCM leaks can negatively affect human health (e.g., domestic hot water tanks). The aim of this study is to evaluate the interactions between the selected commercially available organic (Linpar 17 and 1820) and inorganic (Rubitherm SP22 and SP25) PCMs and metals widely used for PCM encapsulation (aluminum, brass, carbon steel, and copper). The evaluation is based on the calculation of the corrosion rate (CR), and the gravimetric method is used for the determination of the weight variations of the metal samples. The results show good compatibility for all metals with organic PCMs, which is demonstrated by a mass loss as low as 2.1 mg in case of carbon steel immersed in Linpar 1820 for 12 weeks. The exposure of metals to organic PCMs also did not cause any visual changes on the surface except for darker stains, and tarnishing occurred on the copper samples. More pronounced changes were observed in metal samples immersed in inorganic PCMs. The highest CR values were calculated for carbon steel exposed to inorganic PCM Rubitherm SP25 (up to 13.897 mg·cm-2·year-1). The conclusion of the study is that aluminum is the most suitable container material for the tested PCMs as it shows the lowest mass loss and minimal visual changes on the surface after prolonged exposure to the selected PCMs.
- Klíčová slova
- container, corrosion, latent heat storage, metals, phase change materials (PCMs),
- MeSH
- koroze MeSH
- kovy chemie MeSH
- změna skupenství * MeSH
- Publikační typ
- časopisecké články MeSH
- Názvy látek
- kovy MeSH
SIGNIFICANCE: Machine learning is increasingly being applied to the classification of microscopic data. In order to detect some complex and dynamic cellular processes, time-resolved live-cell imaging might be necessary. Incorporating the temporal information into the classification process may allow for a better and more specific classification. AIM: We propose a methodology for cell classification based on the time-lapse quantitative phase images (QPIs) gained by digital holographic microscopy (DHM) with the goal of increasing performance of classification of dynamic cellular processes. APPROACH: The methodology was demonstrated by studying epithelial-mesenchymal transition (EMT) which entails major and distinct time-dependent morphological changes. The time-lapse QPIs of EMT were obtained over a 48-h period and specific novel features representing the dynamic cell behavior were extracted. The two distinct end-state phenotypes were classified by several supervised machine learning algorithms and the results were compared with the classification performed on single-time-point images. RESULTS: In comparison to the single-time-point approach, our data suggest the incorporation of temporal information into the classification of cell phenotypes during EMT improves performance by nearly 9% in terms of accuracy, and further indicate the potential of DHM to monitor cellular morphological changes. CONCLUSIONS: Proposed approach based on the time-lapse images gained by DHM could improve the monitoring of live cell behavior in an automated fashion and could be further developed into a tool for high-throughput automated analysis of unique cell behavior.
- Klíčová slova
- digital holographic microscopy, epithelial–mesenchymal transition, quantitative phase imaging, supervised machine learning,
- MeSH
- algoritmy MeSH
- časosběrné zobrazování MeSH
- epitelo-mezenchymální tranzice * MeSH
- holografie * MeSH
- strojové učení MeSH
- Publikační typ
- časopisecké články MeSH
- práce podpořená grantem MeSH
Quantum phase transitions (QPTs) driven by quantum fluctuations are transitions between distinct quantum phases of matter. At present, they are poorly understood and not readily controlled. Here, scanning tunneling microscopy (STM) and noncontact atomic force microscopy (nc-AFM) are used to explore atomic scale control over quantum phase transitions between two different topological quantum states of a well-defined π-conjugated polymer. The phase transition is driven by a pseudo Jahn-Teller effect that is activated above a certain polymer chain length. In addition, theoretical calculations indicate the presence of long-lasting coherent fluctuations between the polymer's two quantum phases near the phase transition, at finite temperature. This work thus presents a new way of exploring atomic-scale control over QPTs and indicates that emerging quantum criticality in the vicinity of a QPT can give rise to new states of organic matter.
