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Sponsored AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI AI AM CLAUDE, A Beginner's Guide: Learn the basics of working with AI

Author

J. Mendieta-Moreno

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Open access Sep 2026

Partial Atomic Charges, Dipole Moments and Electrostatic Potentials

ABSTRACT Partial atomic charges are indispensable tools in chemistry, materials science, and atomic‐scale modeling of materials, yet they are not uniquely defined. In this work, we introduce a new charge‐assignment model—the Dipole‐Projected Overlap Density (DPOD) charges—and assess it systematically against several ot...

Jorge Vega Martín, D. G. Trabada, Diego Soler-Polo et al. · 0 citations

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