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Hemant K Kashyap
Chemistry

Hemant K Kashyap

Professor

TheoreticalComputational ChemistryMolecular Dynamics (all-atomcoarse-grained and ab initio)Ionic Liquids
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Hemant K Kashyap

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This semester

Nothing recorded this semester.

Earlier

  • CML760

    Computational Quantum Chemistry

    3 (2-0-2) credits · Sem 2, 2025-26, Sem 2, 2024-25, Sem 2, 2023-24

    unrated
  • CML664

    Group Theory & Spectroscopy

    3 (3-0-0) credits · Sem 1, 2024-25

    unrated
  • CML801

    Molecular Modelling and Simulations: Concepts and Techniques

    3 (3-0-0) credits · Sem 1, 2023-24, Sem 1, 2022-23

    unrated
  • CML662

    Statistical Mechanics & Molecular Simulation Methods

    3 (3-0-0) credits · Sem 2, 2022-23

    unrated

Each course has its own page and discussion.

Doing a BTP, MTP, PhD, internship or RA position under Kashyap, scored on five separate axes.

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1 · left yourself to itclosely guided · 10
5
1 · weeks to get a replyresponds same day · 10
5
1 · told exactly what to dopicked my own direction · 10
5
1 · lightpunishing · 10
5
1 · contribution went unacknowledgedscrupulously fair on authorship · 10

These are deliberately not all “high is good”. Someone who wants heavy guidance and someone who wants total autonomy are looking for opposite ends of the Freedom axis. Answer honestly about what it was like; readers will judge fit.

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Areas listed by the department

TheoreticalComputational ChemistryMolecular Dynamics (all-atomcoarse-grained and ab initio)Ionic LiquidsDeep Eutectic SolventsModern Battery ElectrolytesBiomembranesBiomaterials

Publications, via OpenAlex

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Links

  • Department pagechemistry.iitd.ac.in/faculty-profile/22
  • LinkedInSearch by name
33h-index
4615Citations
129Works
85i10

Topic clusters

Ionic liquids properties and applicationsSpectroscopy and Quantum Chemical StudiesAdvanced Battery Materials and TechnologiesMaterial Dynamics and PropertiesLipid Membrane Structure and Behavior

Most recent

  1. Temperature Dependence of Structural Landscape of Thymol–Coumarin Hydrophobic Deep Eutectic Solvents as Revealed by X-ray Scattering and Molecular Simulations · The Journal of Physical Chemistry B, 2026
  2. Direct Growth of Na‐Ion Conducting Na 3 O 15 Si 6 Y Solid Glass Electrolyte With Reduced Interfacial Resistance for Safer Room‐Temperature Sodium–Sulfur Pouch Cells · Angewandte Chemie, 2026
  3. Direct Growth of Na‐Ion Conducting Na 3 O 15 Si 6 Y Solid Glass Electrolyte With Reduced Interfacial Resistance for Safer Room‐Temperature Sodium–Sulfur Pouch Cells · Angewandte Chemie International Edition, 2026
  4. Correction to “Mechanistic Insight on the Stability of Ether and Fluorinated Ether Solvent-Based Lithium Bis(fluoromethanesulfonyl)imide Electrolytes near Li Metal Surface” · The Journal of Physical Chemistry C, 2026
  5. Knifing Action of WS 2 Nanosheets Toward the Inner Membrane of Escherichia coli Compared to Its Mild and Conditional Detrimental Effect on the Bacterial Membrane of S. aureus · Langmuir, 2026 · 1 citations

Matched to Hemant Kumar Kashyap on OpenAlex. Author matching is by name and institution and can be wrong for common names.