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Advanced Search Results For "MATERIALS science"

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 "MATERIALS science"
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Synthesis, Post-Functionalization and Properties of Diphosphapentaarenes.

Publication Type: Academic Journal

Source(s): Chemistry (Weinheim an der Bergstrasse, Germany) [Chemistry] 2023 Jan 24; Vol. 29 (5), pp. e202202769. Date of Electronic Publication: 2022 Nov 29.

Abstract: Linearly-fused polyarenes are an important class of compounds with high relevance in materials science. While modifying the shape and size represents a common means to fine-tune their properties, the precise placement of heteroatoms is a strategy that ...

Mateverse, the Future Materials Science Computation Platform Based on Metaverse.

Publication Type: Academic Journal

Source(s): The journal of physical chemistry letters [J Phys Chem Lett] 2023 Jan 12; Vol. 14 (1), pp. 148-157. Date of Electronic Publication: 2022 Dec 29.

Authors:

Abstract: Currently, computational materials science involves human-computer interaction through coding in software or neural networks. There is still no direct way for human intelligence endorsement. The digitalization of human intelligence should be the ultima...

Emerging Chalcohalide Materials for Energy Applications.

Publication Type: Academic Journal

Source(s): Chemical reviews [Chem Rev] 2023 Jan 11; Vol. 123 (1), pp. 327-378. Date of Electronic Publication: 2022 Nov 21.

Abstract: Semiconductors with multiple anions currently provide a new materials platform from which improved functionality emerges, posing new challenges and opportunities in material science. This review has endeavored to emphasize the versatility of the emergi...

Advanced Materials: Beyond the Horizon of Materials Science.

Publication Type: Editorial & Opinion

Source(s): Advanced materials (Deerfield Beach, Fla.) [Adv Mater] 2023 Jan; Vol. 35 (1), pp. e2211358.

Authors:

Aza-BODIPY-based Fluorescent and Colorimetric Sensors and Probes.

Publication Type: Academic Journal

Source(s): Current organic synthesis [Curr Org Synth] 2023; Vol. 20 (1), pp. 20-60.

Abstract: Aza-boron-dipyrromethenes (Aza-BODIPYs) represent an important class of chromophores absorbing and emitting in the near-infrared (NIR) region. They have unique optical and electronic features and higher physiological and photo stability than other NIR ...

DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science.

Publication Type: Academic Journal

Source(s): Physical chemistry chemical physics : PCCP [Phys Chem Chem Phys] 2022 Dec 07; Vol. 24 (47), pp. 28700-28781. Date of Electronic Publication: 2022 Dec 07.

Abstract: In this paper, the history, present status, and future of density-functional theory (DFT) is informally reviewed and discussed by 70 workers in the field, including molecular scientists, materials scientists, method developers and practitioners. The fo...

Plethora of Non-Covalent Interactions in Coordination and Organometallic Chemistry Are Modern Smart Tool for Materials Science, Catalysis, and Drugs Design.

Publication Type: Editorial & Opinion

Source(s): International journal of molecular sciences [Int J Mol Sci] 2022 Nov 25; Vol. 23 (23). Date of Electronic Publication: 2022 Nov 25.

Authors:

Abstract: Non-covalent interactions are one of the key topics in coordination and organometallic chemistry. Examples of such weak interactions are hydrogen, halogen, and chalcogen bonds, stacking interactions, metallophilic contacts, etc. Non-covalent interactio...

AIEgens Based on Anion-π + Interactions: Design, Synthesis, Photophysical Properties, and Their Applications in Material Science and Biology.

Publication Type: Academic Journal

Source(s): Chembiochem : a European journal of chemical biology [Chembiochem] 2022 Nov 18; Vol. 23 (22), pp. e202200320. Date of Electronic Publication: 2022 Sep 14.

Abstract: The design of novel aggregation-induced emission luminogens (AIEgens), has generally been facilitated by disrupting the possibility of π-π stacking. The recent literature describes a novel strategy to design AIEgens by introducing anion-π + interaction...

Health and Environmental Effect of Advanced Materials and Fine Particles.

Publication Type: Editorial & Opinion

Source(s): Biomolecules [Biomolecules] 2022 Oct 28; Vol. 12 (11). Date of Electronic Publication: 2022 Oct 28.

Authors:

Abstract: With the recent development in material sciences, advanced materials have become terms widely used for new materials [...].

Functional Output Regression for Machine Learning in Materials Science.

Publication Type: Academic Journal

Source(s): Journal of chemical information and modeling [J Chem Inf Model] 2022 Oct 24; Vol. 62 (20), pp. 4837-4851. Date of Electronic Publication: 2022 Oct 10.

Authors:

Abstract: In recent years, there has been a rapid growth in the use of machine learning in material science. Conventionally, a trained predictive model describes a scalar output variable, such as thermodynamic, electronic, or mechanical properties, as a function...

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