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Danish Khan

California Institute of Technology

United States

Research Interests

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Professors in United States Professors in Condensed Matter Physics Condensed Matter Physics professors in United States

Articles (10)

Year:

2025

Year:

2025

Year:

2025

Year:

2025

Year:

2024

Year:

2024

Year:

2023

Year:

2022

Year:

2022

Year:

2021

Collaborators (2)

Indrajit Sinha

Professor

Indian Institute of Technology (BHU), Varanasi

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O. Anatole von Lilienfeld

University of Toronto

CANADA

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Danish Khan

Research Interests

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Articles (10)

Adapting hybrid density functionals with machine learning

Alchemical harmonic approximation based potential for iso-electronic diatomics: Foundational baseline for Δ-machine learning

Generalized convolutional many-body distribution functional representations

SCAN based non-linear double hybrid density functional

Autonomous data extraction from peer reviewed literature for training machine learning models of oxidation potentials

Ag‐based bimetallic clusters as catalysts for p‐nitrophenol reduction by glycerol: A <scp>DFT</scp> investigation

Kernel based quantum machine learning at record rate: Many-body distribution functionals as compact representations

Mechanism of phenol and p-nitrophenol adsorption on kaolinite surface in aqueous medium: A molecular dynamics study

An Interacting Quantum Atoms (IQA) and Relative Energy Gradient (REG) Analysis of the Anomeric Effect

AgI/CuWO4 Z-scheme photocatalyst for the degradation of organic pollutants: Experimental and molecular dynamics studies

Collaborators (2)

Indrajit Sinha

O. Anatole von Lilienfeld

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