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Publications by Kshitij C. Jha
Molecular Structure of Poly(methyl Methacrylate) Surface. I. Combination of Interface-Sensitive Infrared–Visible Sum Frequency Generation, Molecular Dynamics Simulations, and Ab Initio Calculations
Langmuir
Surfaces
Materials Science
Condensed Matter Physics
Interfaces
Electrochemistry
Spectroscopy
Medicine
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Ab Initio Molecular Dynamics Calculations of Ion Hydration Free Energies
Journal of Chemical Physics
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Fluoroethylene Carbonate as a Directing Agent in Amorphous Silicon Anodes: Electrolyte Interface Structure Probed by Sum Frequency Vibrational Spectroscopy and Ab Initio Molecular Dynamics
Action-Derived Ab Initio Molecular Dynamics
International Journal of Applied Mechanics
Mechanics of Materials
Materials Science
Mechanical Engineering
Time-Reversible Ab Initio Molecular Dynamics
Journal of Chemical Physics
Medicine
Theoretical Chemistry
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Formation of N-Doped C60 Studied by Ab Initio Molecular Dynamics Simulations
Materials Transactions
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Condensed Matter Physics
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Ab Initio Calculations for SrTiO3 (100) Surface Structure
AIP Conference Proceedings
Astronomy
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Semiconductor Surface and Interface Dynamics From Tight‐binding Molecular Dynamics Simulations
Journal of Vacuum Science and Technology A: Vacuum, Surfaces and Films
Surfaces
Films
Interfaces
Condensed Matter Physics
Coatings
Determination of an Ethane Intermolecular Potential Model for Use in Molecular Simulations From Ab Initio Calculations
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Ab Initio Molecular Dynamics With Quantum Monte Carlo
Frontiers in Materials
Materials Science
