Search Results - "Krishnan, N. M. Anoop"
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Evidence of a two-dimensional glass transition in graphene: Insights from molecular simulations
Published in Scientific reports (14-03-2019)“…Liquids exhibit a sudden increase in viscosity when cooled fast enough, avoiding thermodynamically predicted route of crystallization. This phenomenon, known…”
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2
Enthalpy Landscape Dictates the Irradiation-Induced Disordering of Quartz
Published in Physical review. X (28-07-2017)“…Under irradiation, minerals tend to experience an accumulation of structural defects, ultimately leading to a disordered atomic network. Despite the critical…”
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3
Predicting the dissolution kinetics of silicate glasses by topology-informed machine learning
Published in Npj Materials degradation (29-08-2019)“…Machine learning (ML) regression methods are promising tools to develop models predicting the properties of materials by learning from existing databases…”
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4
Elucidating the constitutive relationship of calcium–silicate–hydrate gel using high throughput reactive molecular simulations and machine learning
Published in Scientific reports (07-12-2020)“…Prediction of material behavior using machine learning (ML) requires consistent, accurate, and, representative large data for training. However, such…”
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5
MatSciBERT: A materials domain language model for text mining and information extraction
Published in npj computational materials (03-05-2022)“…A large amount of materials science knowledge is generated and stored as text published in peer-reviewed scientific literature. While recent developments in…”
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Predicting the Young’s Modulus of Silicate Glasses using High-Throughput Molecular Dynamics Simulations and Machine Learning
Published in Scientific reports (19-06-2019)“…The application of machine learning to predict materials’ properties usually requires a large number of consistent data for training. However, experimental…”
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7
Long-term creep deformations in colloidal calcium–silicate–hydrate gels by accelerated aging simulations
Published in Journal of colloid and interface science (15-04-2019)“…[Display omitted] When subjected to a sustained load, jammed colloidal gels can feature some delayed viscoplastic creep deformations. However, due to the long…”
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8
Topological Control on the Structural Relaxation of Atomic Networks under Stress
Published in Physical review letters (21-07-2017)“…Upon loading, atomic networks can feature delayed irreversible relaxation. However, the effect of composition and structure on relaxation remains poorly…”
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Irradiation-induced topological transition in SiO2: Structural signature of networks' rigidity
Published in Journal of non-crystalline solids (01-05-2017)“…By affecting the connectivity of atomic networks, composition, temperature, or pressure can induce topological transitions between the three atomic states of…”
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10
Mechanics of Metal-Nanocomposites at Multiple Length Scales: Case of Al-BNNT
Published in Journal of nanomechanics and micromechanics (01-12-2017)“…AbstractMetal-nanocomposites are drawing attention of the composites community due to improvements in stiffness, strength, crack-bridging ability, and…”
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11
Atomic picture of structural relaxation in silicate glasses
Published in Applied physics letters (10-06-2019)“…As nonequilibrium materials, glasses continually relax toward the supercooled liquid state. However, the atomic-scale origin and mechanism of glass relaxation…”
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12
Analytical model of the network topology and rigidity of calcium aluminosilicate glasses
Published in Journal of the American Ceramic Society (01-08-2021)“…Topological constraint theory (TCT) has enabled the prediction of various properties of oxide glasses as a function of their composition and structure…”
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13
Effects of Irradiation on Albite’s Chemical Durability
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (19-10-2017)“…Albite (NaAlSi3O8), a framework silicate of the plagioclase feldspar family and a common constituent of felsic rocks, is often present in the siliceous mineral…”
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14
Rigidity theory of glass: Determining the onset temperature of topological constraints by molecular dynamics
Published in Journal of non-crystalline solids (15-02-2021)“…•We simulate by molecular dynamics a series of calcium silicate glasses.•We compute the fraction of active constraints as a function of temperature.•We…”
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15
Confined Water in Layered Silicates: The Origin of Anomalous Thermal Expansion Behavior in Calcium-Silicate-Hydrates
Published in ACS applied materials & interfaces (28-12-2016)“…Water, under conditions of nanoscale confinement, exhibits anomalous dynamics, and enhanced thermal deformations, which may be further enhanced when such water…”
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16
Looking through glass: Knowledge discovery from materials science literature using natural language processing
Published in Patterns (New York, N.Y.) (09-07-2021)“…Most of the knowledge in materials science literature is in the form of unstructured data such as text and images. Here, we present a framework employing…”
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17
Building a predictive soft armor finite element model combining experiments, simulations, and machine learning
Published in Journal of composite materials (01-04-2023)“…Despite its relevance for law enforcement applications, the design of soft armor has mainly been based on a trial-and-error approach. In this paper, a combined…”
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18
Discovering symbolic laws directly from trajectories with hamiltonian graph neural networks
Published in Machine learning: science and technology (01-09-2024)“…The time evolution of physical systems is described by differential equations, which depend on abstract quantities like energy and force. Traditionally, these…”
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Learning the dynamics of particle-based systems with Lagrangian graph neural networks
Published in Machine learning: science and technology (01-03-2023)“…Physical systems are commonly represented as a combination of particles, the individual dynamics of which govern the system dynamics. However, traditional…”
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Accelerated design of chalcogenide glasses through interpretable machine learning for composition–property relationships
Published in JPhys materials (01-04-2023)“…Chalcogenide glasses (ChGs) possess various outstanding properties enabling essential applications, such as optical discs, infrared cameras, and thermal…”
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