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20202026
most citedEnvironmental effects with Frozen Density Embedding in Real-Time Time-Dependent Density Functional Theory using localized basis functions

22 citations · 34 across the 7 of their papers we have counts for

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physics.chem-ph2023

Chemical bond analysis for the entire periodic table: Energy Decomposition and Natural Orbitals for Chemical Valence in the Four-Component Relativistic Framework

Diego Sorbelli, Paola Belanzoni, Loriano Storchi +4

Chemical bonding is a ubiquitous concept in chemistry and it provides a common basis for experimental and theoretical chemists to explain and predict the structure, stability and r…