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Publications by Chris-Kriton Skylaris
Predicting the Oxygen-Binding Properties of Platinum Nanoparticle Ensembles by Combining High-Precision Electron Microscopy and Density Functional Theory
Nano Letters
Materials Science
Condensed Matter Physics
Mechanical Engineering
Nanoscience
Bioengineering
Nanotechnology
Chemistry
CD1b-restricted GEM T Cell Responses Are Modulated byMycobacterium Tuberculosismycolic Acid Meromycolate Chains
Proceedings of the National Academy of Sciences of the United States of America
Multidisciplinary
Cholesteryl Esters Stabilize Human CD1c Conformations for Recognition by Self-Reactive T Cells
Proceedings of the National Academy of Sciences of the United States of America
Multidisciplinary
A Monte Carlo Resampling Approach for the Calculation of Hybrid Classical and Quantum Free Energies
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
A Practical Approach to Large Scale Electronic Structure Calculations in Electrolyte Solutions via Continuum-Embedded Linear-Scaling DFT
Journal of Physical Chemistry C
Surfaces
Energy
Nanoscience
Theoretical Chemistry
Optical
Magnetic Materials
Films
Nanotechnology
Electronic
Coatings
Physical
Application of New Nanoparticle Structures as Catalysts: General Discussion
Faraday Discussions
Theoretical Chemistry
Physical
Surface Reconstruction Amendment to the Intrinsic Sampling Method
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
Approaching the Basis Set Limit for DFT Calculations Using an Environment-Adapted Minimal Basis With Perturbation Theory: Formulation, Proof of Concept, and a Pilot Implementation
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
A Variational Method for Density Functional Theory Calculations on Metallic Systems With Thousands of Atoms
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
A Practical Approach to Large Scale Electronic Structure Calculations in Electrolyte Solutions via Continuum-Embedded Linear-Scaling DFT
