Basic Mechanisms Research Articles

Suppressed Gold Penetration with the Molybdenum Oxide Interlayer to Increase Power Conversion Efficiency of Perovskite Solar Cells

Perovskite solar cells (PSCs) have undergone an unprecedentedly rapid development in both power conversion efficiency (PCE) and operational durability. However, a number of unknown challenges remain before PSC products are ready to launch. Herein, it is demonstrated that the vacuum deposition of gold (Au) onto the organic hole‐transport layer (HTL) results in Au penetration into the perovskite layer. This Au penetration proves to be a limiting factor in PCE due to detrimental carrier recombination caused by the penetrated Au component inside the perovskite light absorber. To mitigate this issue, a thin molybdenum oxide (MoOx) interlayer between the organic HTL and the Au electrode is introduced, effectively reducing the Au penetration and suppressing the carrier recombination. Consequently, this MoOx introduction increases PCEs from ≈16.9% to ≈19.6% by ≈2.7%. Furthermore, using the MoOx interlayer improves the long‐term durability of PSCs. These findings are crucial in elucidating a basic mechanism that limits PCE and in advancing the fabrication of PSC products with even higher performance.

From anti-Arrhenius to Arrhenius behavior in a dislocation-obstacle bypass: Atomistic simulations and theoretical investigation

Dislocations are the primary carriers of plasticity in metallic materials. Understanding the basic mechanisms for dislocation movement is paramount to predicting the material mechanical response. Relying on atomistic simulations, we observe a transition from non-Arrhenius to Arrhenius behavior in the rate of an edge dislocation overcoming the long-range elastic interaction with a prismatic loop in tungsten. Close to the critical resolved shear stress, the process shows a non-Arrhenius behavior at low temperatures. However, as the temperature increases, the activation entropy starts to dominate, leading to a traditional Arrhenius-like behavior. We have computed the activation entropy analytically along the minimum energy path following Schoeck’s method [1], which captures the cross-over between anti-Arrhenius and Arrhenius domains. Also, the Projected Average Force Integrator (PAFI) [2], another simulation method to compute free energies along an initial transition path, exhibits considerable concurrence with Schoeck’s formalism. We conclude that entropic effects need to be considered to understand processes involving dislocations bypassing elastic barriers close to the critical resolved shear stress. More work needs to be performed to fully understand the discrepancies between Schoeck’s and PAFI compared to molecular dynamics.

A Review of Chloride Corrosion Resistance of Ultra-High-Performance Concret

Extending the service life of reinforced concrete structures can effectively reduce the economic, environmental, resource and energy costs throughout their life cycle. However, a large number of reinforced concrete structures often suffer from corrosion of reinforcing bars due to chloride ion erosion in various environments, which leads to deterioration of performance, the loss of functionality and even safety accidents. As a barrier between reinforcing steel and the external environment, protective layer concrete can effectively prevent chloride ions from contacting the surface of reinforcing steel, thus delaying the corrosion of reinforcing steel and improving the durability of reinforced concrete structures. Ultra-high-performance concrete has a dense microstructure due to its low water-to-cement ratio and elimination of coarse aggregates, which can greatly impede the transport of chloride ions within it, and thus it is expected to significantly improve the service life of reinforced concrete infrastructure. Based on this, this paper firstly summarizes the basic mechanism of chloride ion transport inside cementitious materials, including the movement mode and physicochemical binding mechanism of chloride ions inside the cementitious, and analyzes the current research status and improvement methods of the chloride ion penetration and chloride ion binding capacity of ultra-high-performance concrete.

The ex vivo perfused mouse adrenal gland—a new model to study aldosterone secretion

Aldosterone is a steroid hormone that is important for maintaining the volume and ionic composition of extracellular fluids and is produced in the zona glomerulosa of the adrenal cortex. The basic mechanisms controlling aldosterone secretion are known. However, more detailed studies on the regulation of aldosterone secretion often fail due to the lack of suitable models: although secretion can be studied in cultured adrenocortical cells under defined conditions, the differentiation status of the cells is difficult to control and the complex anatomy of the adrenal cortex is lost. In living animals, the physiological context is intact, but the influences are manifold and the examination conditions cannot be sufficiently controlled. One method that closes the gap between cell models and studies in living animals is the isolated perfused adrenal gland. In the past, this method has provided important data on the pathophysiology of adrenal glands from larger animals, but the technique was not used in mice. Here, we developed a method for isolation and perfusion of the mouse adrenal gland to study aldosterone secretion. This technique preserves the complex anatomical and functional context of the mouse adrenal cortex, to ensure defined experimental conditions and to minimize extra-adrenal influences. Initial series of experiments with the ex vivo perfused mouse adrenal gland show that this model offers the possibility for unique insights into pathophysiological regulatory principles and is suitable for the use of genetically modified mouse models.

Rationale of Basic and Cellular Mechanisms Considered in Updating the Staging System for Diabetic Retinal Disease

Hyperglycemia is a major risk factor for early lesions of diabetic retinal disease (DRD). Updating the DRD staging system to incorporate relevant basic and cellular mechanisms pertinent to DRD is necessary to better address early disease, disease progression, the use of therapeutic interventions, and treatment effectiveness. We sought to reviewpreclinical and clinical evidence on basic and cellular mechanisms potentially pertinent to DRD that might eventually be relevant to update the DRD staging system. Not applicable. The Basic and Cellular Mechanisms Working Group (BCM-WG) of the Mary Tyler Moore Vision Initiative carefully and extensively reviewed available preclinical and clinical evidence through multiple iterations and classified these. Classification was made into evidence grids, level of supporting evidence, and anticipated future relevance to DRD. A total of 40 identified targets based on pathophysiology and other parameters for DRD were grouped into concepts or evaluated as specific candidates. VEGFA, peroxisome proliferator-activated receptor-alpha related pathways, plasma kallikrein, and angiopoietin 2 had strong agreement as promising for use as biomarkers in diagnostic, monitoring, predictive, prognostic, and pharmacodynamic responses as well as for susceptibility/risk biomarkers that could underlie new assessments and eventually be considered within an updated DRD staging system or treatment, based on the evidence and need for research that would fit within a 2-year timeline. The BCM-WG found there was strong reason also to pursue the following important concepts regarding scientific research of DRD acknowledging their regulation by hyperglycemia: inflammatory/cytokines, oxidative signaling, vasoprotection, neuroprotection, mitophagy, and nutrients/microbiome. Promising targets that might eventually be considered within an updated DRD staging system or treatment were identified. Although the BCM-WG recognizes that at this stage little can be incorporated into a new DRD staging system, numerous potential targets and important concepts deserve continued support and research, as they may eventually serve as biomarkers and/or therapeutic targets with measurable benefits to patients with diabetes. Proprietary or commercial disclosure may be found in the Footnotes and Disclosures at the end of this article.

Features of state regulation of defense procurements

The article is devoted to the consideration of state regulation in the field of public procurement, in particular in the defense-industrial complex. The main law defining the basic principles and mechanisms of procurement is the Law of Ukraine «On Public Procurement». However, during the period of martial law, many changes were made in the procedures and mechanisms of public procurement, changes were already made more than once, through the adoption of separate laws and by-laws. The article analyzes the peculiarities of the application of public procurement mechanisms in certain sectors of the economy, in particular the defense-industrial complex. The necessity of modernization and improvement the procurement procedures for successful and effective compliance with the principles of competition and overcoming corruption, and other principles stipulated by legislation, is argued. Mechanisms for conducting procurement procedures are analyzed as one of the key elements of increasing the effectiveness of state economic policy, which is based, in particular, on the principles of fair competition, openness and transparency, non-discrimination of participants, objectivity and impartiality of evaluation of tender offers.
 It is substantiated that it is important to borrow international procurement experience to ensure compliance of national legislation with EU legislation. The issue of ensuring the appropriate level of defense capability of Ukraine in the conditions of countering full-scale military aggression on the territory of Ukraine by the Russian Federation is quite acute. A pressing challenge now is to ensure the rational spending of budget funds and the effective functioning and development of the state defense procurement system. It has been proven that the mechanism for the redistribution of budget funds should have the most transparent order of organization and the order of execution of the concluded procurement contract, which in the case of defense procurement involves reducing the number of closed procurements, excessive secrecy, increasing competitive procedures in the procurement of imported products and services, further improving pricing, canceling profit limits, accounting for inflation and life cycle cost.
 It is argued that consideration of physical, economic and informational security requirements is extremely important. It is about compliance with the principles of protecting customers from military threats, ensuring the simplification of public procurement by reducing the terms of the procurement procedure and simplifying the requirements for procedure participants, the effectiveness of the procurement process and the efficiency of the use of funds, primarily through the involvement of domestic entrepreneurs in tenders and ensuring the development of the domestic market, stability and defense capability.

CNC: A lightweight architecture for Binary Ring-LWE based PQC

In lattice-based cryptography, Ring Learning with Errors (RLWE) is a computationally hard cryptographic problem, comprising three basic mechanisms i.e., key generation, encryption, and decryption. Binary Ring Learning with Error (BRLWE), a new variant of RLWE has been proposed recently to reduce the key size and computational complexity compared to previous RLWE-based schemes. Based on this BRLWE scheme, efficient hardware architectures have been obtained in recent works for lightweight applications. The key operation involved in this scheme is AB+C , where A and C are integer polynomials and B is a binary polynomial. This paper proposes an efficient hardware architecture for BRLWE-based scheme targeted for lightweight applications. The architecture computes the arithmetic operation AB+C, which includes polynomial multiplication and addition over the polynomial ring Zq/(xn+1). The proposed architecture is applied in two conditions, fixed and variable values of q. Experimental results show the architecture proposed has 50% less Area-Delay Product (ADP) and 20% less Power-Delay Product (PDP) compared to the recently reported work for n=256.

Photoaquation of cis-[Rh(dppz)(phen)Cl2]Cl complex prospective as potential light-activated anti-cancer agent

The photoactivated drug usage in anti-cancer therapy, the working mechanism of which doesn’t rely on the formation of reactive oxygen species, allows reducing damage to healthy tissue by controlling toxicity. For instance, light-activated Rh(III) complexes show nuclease activity after irradiation with UV and visible light. However, literature analysis shows a lack of descriptions of basic photochemical mechanisms. Here we report the study of cis-[Rh(dppz)(phen)Cl2]Cl (DPPZPHEN, dppz is dipyrido[3,2-a:2′,3′-c]phenazine, phen is 1,10-phenanthroline) photochemistry in water solutions using stationary photolysis, nanosecond laser flash photolysis and ultrafast pump–probe spectroscopy. After the irradiation with 308 nm light, DPPZPHEN undergoes aquation, which results in the substitution of one chloride ligand by a water molecule and leads to the formation of [Rh(dppz)(phen)(H2O)Cl]Cl2. UV–vis spectra of complex and capillary electrophoresis data were collected and discussed. Laser flash photolysis (355 nm) demonstrates intermediate absorption attributed to the lowest electronic excited state (triplet) of the initial complex. The study of primary photophysical processes showed a rather complicated behavior of transient absorption, which could be described by a set of four exponential functions. The early photophysical processes were described by the scheme including the formation of two excited states of different natures, namely a dppz-based IL state and an LMCT state.

Regulation of laser-induced nanogratings by tuning the Marangoni-plasmon-coupled effect.

Laser-induced subwavelength nanogratings on films find widespread applications in enhancing a spectrum through surface plasmon excitation. It is challenging to achieve high uniformity, diversity, and controllability due to the intricate interplay between two basic mechanisms in laser nanostructuring: the Marangoni effect and surface plasmon polaritons (SPPs). We tune the coupled effect on Ge2Sb2Te5 films by adjusting the laser polarization, whose component controls the two effects' strength ratio. The Marangoni effect dominates when the SPPs' direction mismatches with the growing direction of nanogratings. Tuning this competition relationship helps to create nanogratings with tunable duty cycle and distribution, which are significant for light modulation applications. A highly efficient direct writing method with a line-shaped laser beam is employed to create large-area regular nanogratings by enhancing the effect tuning. We demonstrate diverse Au nanogratings with the aid of a lift-off operation and apply them in surface plasmon-coupled emission (SPCE), showcasing exceptional enhancement and narrowing performance.

PIAS family in cancer: from basic mechanisms to clinical applications.

Protein inhibitors of activated STATs (PIAS) are proteins for cytokine signaling that activate activator-mediated gene transcription. These proteins, as versatile cellular regulators, have been described as regulators of approximately 60 proteins. Dysregulation of PIAS is associated with inappropriate gene expression that promotes oncogenic signaling in multiple cancers. Multiple lines of evidence have revealed that PIAS family members show modulated expressions in cancer cells. Most frequently reported PIAS family members in cancer development are PIAS1 and PIAS3. SUMOylation as post-translational modifier regulates several cellular machineries. PIAS proteins as SUMO E3 ligase factor promotes SUMOylation of transcription factors tangled cancer cells for survival, proliferation, and differentiation. Attenuated PIAS-mediated SUMOylation mechanism is involved in tumorigenesis. This review article provides the PIAS/SUMO role in the modulation of transcriptional factor control, provides brief update on their antagonistic function in different cancer types with particular focus on PIAS proteins as a bonafide therapeutic target to inhibit STAT pathway in cancers, and summarizes natural activators that may have the ability to cure cancer.

Wasserstein Differential Privacy

Differential privacy (DP) has achieved remarkable results in the field of privacy-preserving machine learning. However, existing DP frameworks do not satisfy all the conditions for becoming metrics, which prevents them from deriving better basic private properties and leads to exaggerated values on privacy budgets. We propose Wasserstein differential privacy (WDP), an alternative DP framework to measure the risk of privacy leakage, which satisfies the properties of symmetry and triangle inequality. We show and prove that WDP has 13 excellent properties, which can be theoretical supports for the better performance of WDP than other DP frameworks. In addition, we derive a general privacy accounting method called Wasserstein accountant, which enables WDP to be applied in stochastic gradient descent (SGD) scenarios containing subsampling. Experiments on basic mechanisms, compositions and deep learning show that the privacy budgets obtained by Wasserstein accountant are relatively stable and less influenced by order. Moreover, the overestimation on privacy budgets can be effectively alleviated. The code is available at https://github.com/Hifipsysta/WDP.

Structures of LIG1 provide a mechanistic basis for understanding a lack of sugar discrimination against a ribonucleotide at the 3'-end of nick DNA

Human DNA ligase 1 (LIG1) is the main replicative ligase that seals Okazaki fragments during nuclear replication and finalizes DNA repair pathways by joining DNA ends of the broken strand breaks in the three-steps of ligation reaction. LIG1 can tolerate the RNA strand at the upstream of the nick, yet an atomic insight into the sugar discrimination mechanism by LIG1 against a ribonucleotide at the 3'-terminus of nick DNA is unknown. Here, we determined X-ray structures of LIG1/3'-RNA-DNA hybrids and captured the ligase during pre- and post-step 3 the ligation reaction. Furthermore, the overlays of 3'-rA:T and 3'-rG:C step 3 structures with step 2 structures of canonical 3'-dA:T and 3'-dG:C uncover a network of LIG1/DNA interactions through Asp570 and Arg871 side chains with 2'-OH of the ribose at nick showing a final phosphodiester bond formation and the other ligase active site residues surrounding the AMP site. Finally, we demonstrated that LIG1 can ligate the nick DNA substrates with preinserted 3'-ribonucleotides as efficient as Watson-Crick base-paired ends in vitro. Together, our findings uncover a novel atomic insight into a lack of sugar discrimination by LIG1 and the impact of improper sugar on the nick sealing of ribonucleotides at the last step of DNA replication and repair.

T2MAC: Targeted and Trusted Multi-Agent Communication through Selective Engagement and Evidence-Driven Integration

Communication stands as a potent mechanism to harmonize the behaviors of multiple agents. However, existing work primarily concentrates on broadcast communication, which not only lacks practicality, but also leads to information redundancy. This surplus, one-fits-all information could adversely impact the communication efficiency. Furthermore, existing works often resort to basic mechanisms to integrate observed and received information, impairing the learning process. To tackle these difficulties, we propose Targeted and Trusted Multi-Agent Communication (T2MAC), a straightforward yet effective method that enables agents to learn selective engagement and evidence-driven integration. With T2MAC, agents have the capability to craft individualized messages, pinpoint ideal communication windows, and engage with reliable partners, thereby refining communication efficiency. Following the reception of messages, the agents integrate information observed and received from different sources at an evidence level. This process enables agents to collectively use evidence garnered from multiple perspectives, fostering trusted and cooperative behaviors. We evaluate our method on a diverse set of cooperative multi-agent tasks, with varying difficulties, involving different scales and ranging from Hallway, MPE to SMAC. The experiments indicate that the proposed model not only surpasses the state-of-the-art methods in terms of cooperative performance and communication efficiency, but also exhibits impressive generalization.

Decreasing alpha flow releases task-specific processing paths

Abstract Directing and maintaining attention toward relevant information and away from non-relevant information is a critical competence of higher-order nervous systems. Here, we used directed connectivity to investigate how the human brain prioritizes appropriate processing paths when participants are performing a behavioral task requiring attention in the visual or the auditory modality. We show that the efficient transfer of information relevant for the task is mediated by a region- and task-specific decrease of alpha band connectivity from the parietal and, in case a motor response is required, motor cortex to the relevant sensory cortices. Further, alpha-band connectivity modulations reliably predict alpha power modulations in the task-related sensory cortices, particularly where the task-irrelevant cortex is inhibited via local alpha power increases. We suggest that the task- and region-specific modulation of alpha-band connectivity in the present study is a basic neuronal mechanism orchestrating the allocation of task-relevant neuronal resources related to and possibly underlying the previously reported sensory alpha power modulations in association with the allocation of competing attentional resources.

Abstract 4388: Tumor-associated RhoA mutants interact with effectors in both GDP- and GTP-bound states

Abstract RhoA is the founding member of the Ras-homology (Rho) small GTPase family and is a master regulator for multiple cell functions. Recurrent RhoA mutations have been identified in several human cancers, particularly in leukemia/lymphoma and gastric cancer. Intriguingly, both gain-of-function and loss-of-function mutations of RhoA are present, suggesting that RhoA GTPase may have a more sophisticated role in cancer and requires more rigorous investigations. Here, we have focused on two of the gain-of-function RhoA mutations identified in Adult T cell Leukemia/lymphoma (ATLL) at residue A161 (A161P and A161V) and aim to reveal the underlying mechanistic basis for their function by biochemical and structural analyses. We found that in contrast to conventional gain-of-function RhoA mutants such as RhoAG14V and RhoAQ63L which affect the GTP-hydrolysis activity, RhoAA161P and RhoAA161Vare both fast-cycling with drastically increased nucleotide dissociation and association rates, but only slightly reduced GTP-hydrolysis activity. We solved the crystal structures of GDP-bound RhoAA161P and RhoAA161V and saw that while RhoAA161P displays impaired solvent-mediated interactions to the bound nucleotide, RhoAA161V has a more exposed nucleotide binding pocket compared to RhoAWT and RhoAA161P. Interestingly, RhoAA161P and RhoAA161Vcan interact with effector targets in the GDP-bound states. Further 1H-15N HSQC NMR study provides evidence of the active population in GDP-bound RhoAA161V. Molecule dynamics (MD) simulations show that the dynamic properties of RhoA switch regions are affected differently by the two mutations. Thus, RhoAA161V and RhoAA161P are fast-cycling mutants with distinct mechanisms, and both likely endow their GDP-bound state towards an active conformation. These findings provide a better understanding of the oncogenic role of RhoA mutations in cancer and shine light on how changes in RhoA protein dynamic properties caused by mutations may affect its function. Citation Format: Yuan Lin, Theresa A. Ramelot, Simge Senyuz, Attila Gursoy, Hyunbum Jang, Ruth Nussinov, Ozlem Keskin, Yi Zheng. Tumor-associated RhoA mutants interact with effectors in both GDP- and GTP-bound states [abstract]. In: Proceedings of the American Association for Cancer Research Annual Meeting 2024; Part 1 (Regular Abstracts); 2024 Apr 5-10; San Diego, CA. Philadelphia (PA): AACR; Cancer Res 2024;84(6_Suppl):Abstract nr 4388.

A practical and robust method to evaluate metabolic fluxes in primary pancreatic islets

ObjectiveEvaluation of mitochondrial oxygen consumption and ATP production is important to investigate pancreatic islet pathophysiology. Most studies use cell lines due to difficulties in measuring primary islet respiration, which requires specific equipment and consumables, is expensive and poorly reproducible. Our aim was to establish a practical method to assess primary islet metabolic fluxes using standard commercial consumables. MethodsPancreatic islets were isolated from mice/rats, dispersed with trypsin, and adhered to pre-coated standard Seahorse or Resipher microplates. Oxygen consumption was evaluated using a Seahorse Extracellular Flux Analyzer or a Resipher Real-time Cell Analyzer. ResultsWe provide a detailed protocol with all steps to optimize islet isolation with high yield and functionality. Our method requires a few islets per replicate; both rat and mouse islets present robust basal respiration and proper response to mitochondrial modulators and glucose. The technique was validated by other functional assays, which show these cells present conserved calcium influx and insulin secretion in response to glucose. We also show that our dispersed islets maintain robust basal respiration levels, in addition to maintaining up to 89% viability after five days in dispersed cultures. Furthermore, OCRs can be measured in Seahorse analyzers and in other plate respirometry systems, using standard materials. ConclusionsOverall, we established a practical and robust method to assess islet metabolic fluxes and oxidative phosphorylation, a valuable tool to uncover basic β-cell metabolic mechanisms as well as for translational investigations, such as pharmacological candidate discovery and islet transplantation protocols.

MORE FLORET1 controls anther development by negatively regulating key tapetal genes in both diploid and tetraploid rice.

Polyploid hybrid rice (Oryza sativa) has great potential for increasing yields. However, hybrid rice depends on male fertility and its regulation, which is less well studied in polyploid rice than in diploid rice. We previously identified a MYB transcription factor, MORE FLORET1 (MOF1), whose mutation causes male sterility in neo-tetraploid rice. MOF1 expression in anthers peaks at anther Stage 7 (S7) and progressively decreases to low levels at S10. However, it remains unclear how the dynamics of MOF1 expression contribute to male fertility. Here, we carefully examined anther development in both diploid and tetraploid mof1 rice mutants, as well as lines ectopically expressing MOF1 in a temporal manner. MOF1 mutations caused delayed degeneration of the tapetum and middle layer of anthers and aberrant pollen wall organization. Ectopic MOF1 expression at later stages of anther development led to retarded cytoplasmic reorganization of tapetal cells. In both cases, pollen grains were aborted and seed production was abolished, indicating that precise control of MOF1 expression is essential for male reproduction. We demonstrated that five key tapetal genes, CYP703A3 (CYTOCHROME P450 HYDROXYLASE 703A3), OsABCG26 (Oryza sativa ATP BINDING CASSETTE G26), PTC1 (PERSISTENT TAPETAL CELL1), PKS2 (POLYKETIDE SYNTHASE 2), and OsABCG15 (Oryza sativa ATP BINDING CASSETTE G15), exhibit expression patterns opposite to those of MOF1 and are negatively regulated by MOF1. Moreover, DNA affinity purification sequencing (DAP-seq), luciferase activity assays, and electrophoretic mobility shift assays indicated that MOF1 binds directly to the PKS2 promoter for transcriptional repression. Our results provide a mechanistic basis for the regulation of male reproduction by MOF1 in both diploid and tetraploid rice. This study will facilitate the development of polyploid male sterile lines, which are useful for breeding of polyploid hybrid rice.

Advancing bioenergetics-based modeling to improve climate change projections of marine ecosystems

Climate change has rapidly altered marine ecosystems and is expected to continue to push systems and species beyond historical baselines into novel conditions. Projecting responses of organisms and populations to these novel environmental conditions often requires extrapolations beyond observed conditions, challenging the predictive limits of statistical modeling capabilities. Bioenergetics modeling provides the mechanistic basis for projecting climate change effects on marine living resources in novel conditions, has a long history of development, and has been applied widely to fish and other taxa. We provide our perspective on 4 opportunities that will advance the ability of bioenergetics-based models to depict changes in the productivity and distribution of fishes and other marine organisms, leading to more robust projections of climate impacts. These are (1) improved depiction of bioenergetics processes to derive realistic individual-level response(s) to complex changes in environmental conditions, (2) innovations in scaling individual-level bioenergetics to project responses at the population and food web levels, (3) more realistic coupling between spatial dynamics and bioenergetics to better represent the local- to regional-scale differences in the effects of climate change on the spatial distributions of organisms, and (4) innovations in model validation to ensure that the next generation of bioenergetics-based models can be used with known and sufficient confidence. Our focus on specific opportunities will enable critical advancements in bioenergetics modeling and position the modeling community to make more accurate and robust projections of the effects of climate change on individuals, populations, food webs, and ecosystems.

Improved numerical solution of anisotropic poroelastic wave equation in microseismicity: Graphic process unit acceleration and moment tensor implementation

AbstractThe accuracy and computational efficiency of full waveform forward modelling in poroelastic media are crucial for microseismic monitoring. It enables intuitive, precise and efficient simulation of subsurface responses, thereby improving the reliability of moment tensor inversion and seismic source mechanism interpretation. Additionally, it reflects the role of fluid effects in waveform evolution. In this paper, based on the Biot mechanism, we derived the first‐order velocity–stress equation of poroelastic media and discretized the model using a rotated staggered grid. The rotated staggered grid can well adapt to anisotropic media with high contrast parameters. We provide the finite difference formula based on graphic process unit–acceleration and moment tensor and also provide the graphic process unit workflow for forward modelling of anisotropic poroelastic media. First, two models with different grid sizes were run based on single graphic process unit, 1‐thread Central Processing Unit (CPU) and 16‐thread CPU. The results show that the speedup factors are approximately 14.3 and 3.7, respectively, compared with the running time of 1‐thread CPU and 16‐thread CPU. Then, we compare and evaluate the response of three basic source mechanisms (isotropic expansion, double couple and compensated linear vector dipole) in the model. The comparison of analytical and numerical results verifies the effectiveness of the method. Furthermore, wavefield snapshots of two typical anisotropic media (vertical transversely isotropic and horizontal transversely isotropic) are analysed to correspond to different moment tensor sources. The results showed that the source mechanism does not change the isotropic and anisotropic plane and the wave travel time, but it does change the polarization amplitude of the velocity component. The attenuation of slow qP‐wave increases along with the increase of the value of viscosity. The effect of permeability on wavefield appears with the opposite effect of viscosity. Finally, the seismic waveform differences between multi‐layer elastic media and poroelastic media are compared and analysed. The results showed that the seismic wavefield and waveform of poroelastic media are more complex, the propagation speed of seismic waves is faster, but the attenuation of seismic waves is stronger.

Degradation of Water Pollutants by Biochar Combined with Advanced Oxidation: A Systematic Review

Recently, biochar has emerged as a promising option for environmentally friendly remediation due to its cost-effectiveness, extensive surface area, porosity, and exceptional electrical conductivity. Biochar-based advanced oxidation procedures (BC-AOPs) have gained popularity as an effective approach to breaking down organic pollutants in aqueous environments. It is commonly recognized that the main reactive locations within BC-AOPs consist of functional groups found on biochar, which encompass oxygen-containing groups (OCGs), imperfections, and persistent free radicals (PFRs). Additionally, the existence of metallic components supported on biochar and foreign atoms doped into it profoundly impacts the catalytic mechanism. These components not only modify the fundamental qualities of biochar but also serve as reactive sites. Consequently, this paper offers a comprehensive review of the raw materials, preparation techniques, modification approaches, and composite catalyst preparation within the biochar catalytic system. Special attention is given to explaining the modifications in biochar properties and their impacts on catalytic activity. This paper highlights degradation mechanisms, specifically pathways that include radical and non-radical processes. Additionally, it thoroughly examines the importance of active sites as catalysts and the basic catalytic mechanism of BC-AOPs. Finally, the potential and future directions of environmental remediation using biochar catalysts and advanced oxidation processes (AOPs) are discussed. Moreover, suggestions for future advancements in BC-AOPs are provided to facilitate further development.