Materials Literature
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This paper proposes the theory of Molecular Law Reconstruction, shifting the focus from AI-driven molecular prediction to the automated discovery of minimal chemical laws from observational data. Instead of aiming to predict molecules, the core objective is to reconstruct the fundamental laws governing a chemical syst…
This paper introduces the concept of Molecular Phase Space Reconstruction (MPSR), a novel approach to understanding chemical systems that addresses the limitations of traditional methods. The core idea centers on moving beyond representing molecules as static structures and instead conceptualizing them as trajectories…
Bacteria of the Bacillus genus are known in agroecology as a powerful tool for biocontrol due to their ability to produce secondary metabolites that have a suppressive effect on many phytopathogens. This work demonstrates an environmentally friendly approach to the synthesis of silver nanoparticles (NPs) using cell-fr…
The efficient recycling of polyethylene terephthalate (PET) waste is essential for sustainable development, owing to the extensive utilization of this plastic in daily life. However, the high depolymerization energy barrier inherent to conventional single thermal catalytic technology constrains its reaction efficiency…
Thermal transport in crystalline solids generally occurs via particle-like phonon propagation. Here, we demonstrate the dominant unusual wave-like phonon transport and high thermoelectric figure-of-merit (zT) of ∼1.42 at 673 K in crystalline TlCu 5 Se 3 due to the strong anharmonicity exerted by confined Cu dynamic di…
ABSTRACT Food preservation is achieved through the use of preservatives alongside preservation technologies to ensure food safety, quality, and shelf life by inhibiting microbial growth, oxidation, and enzymatic breakdown. Preservatives are classified as natural or synthetic, each with distinct properties and mechanis…
This paper introduces Chemical Category Theory (CCT), a novel framework for understanding and unifying molecular phenomena using the principles of category theory. CCT posits that molecules are treated as objects within a category, with morphisms representing chemical reactions and transformations. Functors are utiliz…
The inherent complexity and lack of a unified description within the field of catalysis have presented a significant challenge to understanding and predicting catalytic behavior. This work proposes a novel framework, the Universal Catalyst Genome (UCG), to address this issue. The UCG posits that each catalyst possesse…
Silver nanoparticles (AgNPs) were synthesised using an aqueous seed kernel extract of Entada rheedii Spreng. and evaluated for physicochemical characteristics and selected catalytic and biological activities. Nanoparticle formation was assessed by Fourier-transform infrared spectroscopy, X-ray diffraction, zeta-potent…
Abstract Installations of the 3,5-di(pyrrol-2-yl)BODIPY strap across the meso position of B(III) submonoazaporphyrin, B(III) subporphyrin, and Ni(II) porphyrin resulted in the formation of expanded porphyrins with a dual electronic network consisting of a local diatropic ring current of the original aromatic segments…
The present study introduces a colorimetric immunosensor for the detection of bone turnover biomarker C-terminal telopeptide of type I collagen (CTX-1), which is one of the prominent biomarkers in osteoporotic conditions. Elevated CTX-1 level increases the fracture risk to approximately 2-folds as compared to normal b…
Concentrated latex processing facilities are confronted with issues related to high residual phosphate levels in latex. This study was conducted to determine the effects of ammonia preservative systems on residual phosphate levels. Two grades of CL namely, 0.7% ammoniated CL (HACL) and the 0.2% ammoniated CL (LACL) we…
This paper introduces the Universal Reaction Compression (URC) theory, a novel approach to tackling the computational challenges inherent in simulating complex chemical reactions. The core principle of URC rests on the identification of a Minimal Reaction Basis (MRB) for any given reaction network, irrespective of its…
By imposing φ-scaled golden ratio phase rotations on the 240 E8 root vectors within the 132Hz base lattice, the geometry self-organizes into a non-Abelian information manifold where each root encodes a quantized logical state via its zero-divisor closure. This creates a deterministic yet non-periodic encoding scheme c…
Wurtzite zinc oxide is a reference wide-band-gap oxide for optoelectronics, yet density functional studies of its cation substitution remain fragmented and contradictory. This review critically synthesises first-principles results on Fe- and Mg-doped ZnO, two substituents of opposing chemistry: Fe, an open-shell 3d io…
Magnetism can be considered not only an inherent property of materials but also an external "knob" to regulate structure-property relationships and dynamic interfacial processes. This dissertation explores magnetic materials from three complementary yet independent perspectives, with the core theme being the functiona…
ABSTRACT Two‐dimensional (2D) transition metal dichalcogenides (TMDs) exhibit great potential for nonlinear photonics applications due to their large second‐order nonlinear coefficients and prominent two‐photon absorption effect. However, the ultrafast carrier dynamics under nonlinear excitation, especially the excita…
Carbon Quantum Dots (CQDs) have emerged as a prominent class of carbon-based nanomaterials for optoelectronic applications. In this work, the electronic structure of N, O co-doped CQDs with a carboxylic acid functional group was extensively studied via First-Principles density functional theory computations performed…
The growing demand for energy-efficient information processing is pushing conventional complementary metal-oxide-semiconductor (CMOS) technology toward its fundamental limits, driving the search for alternative material platforms. Among these, magnetic systems are attractive for next-generation devices because they ca…
This white paper covers jewelry and arts workflows using direct-print, castable and specialty-finish 3Dresyns materials. Jewelry and arts applications require a combination of detail reproduction, surface finish, colour, burnout behaviour, flexibility or rigidity, wax-like handling where relevant and compatibility wit…