National Institute Of Materials Physics - Romania

The study of spectral gamma-ray logs plays a critical role in understanding the lithofacies and depositional environments of subsurface geologic formations. This research focuses on the Lam Member within the Habban oilfield, located in the Sab'atayn Basin, Yemen. By integrating spectral gamma-ray data with core analysis and other geological datasets, this study aims to provide insights into the stratigraphic distribution, mineral composition, and depositional processes of the Lam Member. Key parameters, such as thorium, uranium, and potassium concentrations, recorded from two wells were analyzed to infer sedimentary characteristics and environmental conditions. The results reveal significant lithologic heterogeneity and suggest a complex interplay of fluvial and marine depositional systems, enhancing the understanding of the basin petroleum potential. The Lam Member comprises interbedded carbonate (dolomite) and claystone with intercalated sandstone. Spectral gamma-ray results indicate that clay minerals primarily consist of mixed-layer clays, chlorite, kaolinite, and minor illite. Based on the Th/U ratio (less than 2), the depositional environment is identified as marine.

Chalcogenide glasses (ChGs) are a class of amorphous materials presenting remarkable mechanical, optical, and electrical properties, making them promising candidates for advanced photonic and optoelectronic applications. With the increasing integration of artificial intelligence in modern materials design, we are able to systematically select, prepare, and optimize appropriate compositions for desired applications in a manner that was unachievable before. This study employs various machine learning models to reliably predict the refractive index at 20 degrees C using a small dataset of 541 samples extracted from the SciGlass database. The input for the algorithms consists of a selected set of physico-chemical features computed for the chemical composition of each entry. Additionally, these algorithms served as inner models for an ensemble logistic regression estimator that achieved a superior R2 value of 0.8985. SHAP feature analysis of the second-best model, CatBoostRegressor (R2 = 0.8920), revealed the importance of elemental density, atomic weight, ground state atomic gap, and fraction of p valence electrons in tuning the value of the refractive index of a chalcogenide compound.

Today, flexible and lightweight electronics are regarded as a viable alternative to conventional rigid and heavy devices in various application fields. In the optoelectronic area, organic semiconductors offer advantages such as high absorption coefficients, low processing temperatures, mechanical flexibility and compatibility with plastic substrates, while inorganic nanostructures provide good electronic properties and high thermal stability. Thus, composite films with enhanced properties can be achieved by inserting inorganic nanostructures within organic layers. In this research work, CuS nanoparticles were prepared by wet chemical precipitation and then added to an organic mixture containing poly(3-hexylthiophene) (P3HT) and N,N-bis-(1-dodecyl)perylene-3,4,9,10 tetracarboxylic diimide (AMC14), a chemically synthesized semiconductor, for fabricating hybrid composite films by matrix assisted pulsed laser evaporation (MAPLE) on indium tin oxide/poly(ethylene terephthalate) (ITO/PET) flexible substrates. A comparative assessment of the morphological, compositional, optical and electrical properties of the composite (P3HT:AMC14:CuS) and organic (P3HT:AMC14) layers was performed to evaluate their applicability in the photovoltaic cells. The transmission and emission spectra of the composite films are dominated by the optical features of AMC14, a perylene diimide derivative compound used as acceptor. In the case of devices based on MAPLE deposited composite layer fabricated on ITO/PET substrates, the electrical measurements carried under illumination revealed an improvement in the open circuit voltage parameter emphasizing their potential applications in the flexible device area.

Following the approach of inducing structural constrains for the creation of polar nanodomains/nanoregions in the perovskite thin films, the photoelectrochemical properties of complex heterostructures based on LaFeO3 and BiFeO3 materials have been studied in correlation with the imposed structural strain and polarization orientation anisotropy conditions. The LFO/BFO thin film heterostructures have been tested using photoelectrochemical (PEC) technique. The recorded photocurrent values for the heterostructure with the LFO layer on top- LFO/BFO/STON- in the potentiodinamic regime are considerably higher (similar to 1.64 mA/cm(2) at 2 V vs RHE) than those obtained for BFO/LFO/STON heterostructure where the BFO layer is acting as the surface layer (similar to 0.32 mA/cm(2) at 2 V vs RHE). Moreover, the LFO/BFO/STON heterostructure exhibits both photocathodic and photoanodic behavior. The atomic resolution STEM data demonstrate the polarization orientation anisotropy in LFO/BFO/STON heterostructure, due to the cooperative effects of competing surface chemistry and polarization of the LFO/BFO interface over the magnitude and orientation of the Fe3+ cations displacement within the La3+ cages. For the BFO/LFO/STON heterostructure however, robust single-oriented domains with large Fe3+ cations displacement characteristics for long-range ferroelectric order, has been revealed also. Taking into account the possibility to control the PEC features such as charge distribution/transport characteristics for both photocathodic/photoanodic reactions, as well as the control of the polarization direction without a pre-poling process, this work is of relevance for applications where the use of a top electrode is not possible.

This study examines the impact of shale volume (Vsh) and clay mineral distribution on the petrophysical properties and reservoir quality of the Matulla Formation in the Gulf of Suez, a critical factor in global hydrocarbon exploration and production. Understanding how shale affects porosity, permeability, and fluid saturation enhances reservoir characterization, optimizing recovery techniques such as hydraulic fracturing and sustainable resource management. The evaluation process involved calculating shale volume using the neutron-density method, with values ranging from 1.9% to 11% across four wells (GS323-1, GS323-2A, GS323-3, GS323-4A). Clay minerals have been identified through Potassium-Thorium (K-Th) cross-plot include chlorite, illite, kaolinite, montmorillonite, and mixed-layer clays. Montmorillonite and chlorite negatively impact porosity and permeability, while kaolinite and illite improve hydrocarbon retention. Shale distribution analysis using the Thomas and Stieber model showed both laminated and dispersed forms, where laminated shales had minimal blockage, and dispersed clays significantly reduced the reservoir quality. Results reveal that wells with low Vsh (GS323-1 and GS323-4A) which ranges from 1.5 to 2% exhibit excellent reservoir quality, with high porosity (14%), high permeability (317-320.7 mD), and low water saturation (32-44%). Moderate Vsh wells (GS323-2A) show reduced porosity (13%), permeability (220 mD), and increased water saturation (46%), reflecting good but diminished quality. High Vsh well (GS323-3) display lower porosity (12%), permeability (140 mD), and moderate water saturation (37%), indicating challenges in fluid flow. This study highlights the need for tailored strategies to mitigate high shale content and swelling clays, offering valuable insights into optimizing hydrocarbon exploration and production in shale-influenced reservoirs worldwide.

Photoanodes based Ce-doped ZnO nanorods arrays were prepared by hydrothermal method in order to improve photoelectrochemical efficiency of ZnO photoanodes in water splitting process. Scanning electron microscopy investigation showed ZnO based nanorods with length of around 500 nm and different thicknesses and growth directions. Some morphological changes were noted following the thermal treatment. Energy-dispersive X-ray analysis and X-ray photoelectron spectroscopy measurements proved the presence of cerium species both in bulk and on the surface of ZnO nanorods. A current density of 2.44 mA/cm(2) at 1.23 V against the reversible hydrogen electrode (0.265 V vs. Ag/AgCl) was obtained for Ce-doped ZnO sample, which is >162% increase over that of ZnO sample. The increased photocurrent value obtained for this sample was correlated with the passivation of surface defects evidenced by photoluminescence study and the increased concentration of Ce3+ on the surface. Also, the electrochemical impedance spectroscopy measurements suggested that Ce doping improves the charge transfer in bulk.

The field of newly developed two-dimensional (2D) materials with low symmetry and structural in-plane anisotropic properties has grown rapidly in recent years. The phosphorene analog of group IV monochalcogenides is a prominent subset of this group that has attracted a lot of attention because of its unique in-plane anisotropic electronic and optical properties, crystalline symmetries, abundance in the earth's crust, and environmental friendliness. This article presents a review of the latest research advancements concerning 2D group IV monochalcogenides. It begins with an exploration of the crystal structures of these materials, alongside their optical and electronic properties. The review continues by discussing the various techniques employed for the synthesis of layered group IV monochalcogenides, including both bottom-up methods such as vapor-phase deposition and top-down techniques like mechanical and/or liquid-phase exfoliation. In the final part, the article emphasizes the application of 2D group IV monochalcogenides, particularly in the fields of photocatalysis, photodetectors, nonlinear optics, sensors, batteries, and photovoltaic cells.

This study explores the development of highly sensitive hydrogen sulfide (H2S) gas sensors employing hierarchical aluminum-doped zinc oxide (AZO) nanostructures. Vertically oriented AZO nanoplatelets with Al/ZnO molar ratios of 4% and 6% were successfully synthesized using an automated successive ionic layer adsorption and reaction (SILAR) technique. The morphological features of the AZO films significantly changed with the Al content. The AZO thin films exhibited a polycrystalline wurtzite structure and an increase in crystallite size with increasing Al concentrations. This work demonstrates that our AZO sensor structures achieved a maximum response at 150 ppm H2S and 573 K of 23.3%, being characterized by fast response and recovery times of 28 and 464 s, respectively. Notably, the 6% AZO samples exhibited an augmented selective sensitivity to H2S, demonstrating stable detection performance. Additionally, the significant improvement in detection capabilities can be attributed to the synergistic effects of electronic and chemical sensitization. These effects enhance the formation of active sites and create doping-induced defects while providing shorter and more efficient diffusion paths for the electrons, significantly improving the sensor's sensitivity and response speed.

Most photocatalytic processes involve physicochemical phenomena occurring at the semiconductor-water interface. The interfacial charge transfer strongly depends on the charge carrier self-trapping or defect-based trapping mechanisms active in the crystal lattice of the photocatalyst. Thus, the crystal lattice distortion is expected to influence the photocatalytic efficiency during polymorphic phase transformations (PPT). A simple synthesis method involving the ultrasound-assisted excess hydrolysis of titanium tetra-isopropoxide (TTIP) (hydrolysis ratio (number of moles of water/number of moles of TTIP) r = 245) was used to obtain multiphase titanium dioxide (TiO2) nanomaterials with complex defect structures. Electron paramagnetic resonance (EPR) spectroscopy was employed to characterize the paramagnetic centers in the synthesized TiO2 and their behavior during incipient PPT. The calcined samples showed a complex defect structure comprising three types of paramagnetic centers: F+-centers (an electron trapped in an oxygen vacancy (Ov)), V-centers (oxygen ions with trapped holes) and paramagnetic centers involving Ti3+ such as Ti3+- Ov. The sample obtained at 600 degrees C, temperature marking the onset of a massive mixed transformation of anatase into rutile and brookite, composed of approximately 81 % anatase, 10 % brookite, and 9 % rutile, exhibited an intense and broadened EPR signal and enhanced photocatalytic activity for hydroxyl radical generation and hydrogen production by water splitting, despite its rather low specific surface area of 34 m2/g. The results revealed the synergistic effects of charge carrier trapping mechanisms in the early stages of PPT, boosting the photocatalytic performance of TiO2. The present study supports the design of facile synthesis methods for better TiO2 photocatalysts and promotes the development of further studies regarding lattice defect engineering during phase transformations in nanomaterials.

In this work, we investigated the influence of reduced graphene oxide (RGO) on the electrical performances of ZnO/Ag multilayer transparent conductive electrodes. RGO flakes were successfully laser transferred by matrix assisted pulsed laser evaporation (MAPLE) using frozen targets obtained from suspensions of commercially chemically RGO powder dispersed in dimethyl sulfoxide (DMSO). The main deposition parameters such as RGO concentration, laser fluence, number of the laser pulses and deposition pressure were varied to identify the optimal morphological and optical characteristics. The laser transfer conditions for the RGO structures with the best transmittance were further employed in preparation of RGO/Ag/ZnO multilayer transparent conductive electrodes (MTCE). Thus, the MAPLE deposited RGO structures were covered with metal (Ag) by vacuum thermal evaporation (VTE) and subsequently with metal oxide (ZnO) by radio frequency magnetron sputtering (RF-MS). In comparison to the optical and electrical properties of a ZnO/Ag/ZnO reference structure, the results emphasize that the RGO/Ag/ZnO are featured by a similar transmittance (similar to 82-85 %) and improved sheet resistance (similar to 10.6 Omega/square, meaning up to 2-fold smaller).