article Open AccessTop 1% cited
Introducing DDEC6 atomic population analysis: part 3. Comprehensive method to compute bond orders
RSC Advances · 2017 · Vol. 7(72) · pp. 45552–45581
Thomas A. Manz✉(New Mexico State University)
Abstract
A new method to compute accurate bond orders for metallic, covalent, polar-covalent, ionic, multi-centered, aromatic, dative, dispersion, and hydrogen bonding.
Advanced Chemical Physics StudiesCrystallography and molecular interactionsFree Radicals and AntioxidantsCovalent bondIonic bondingHydrogen bondPolarDispersion (optics)MetalComputational chemistryMaterials scienceMetallic bondingPopulation
Funding
- National Science Foundation
- Division of Materials Research
- Division of Advanced Cyberinfrastructure
Citations
495
FWCI
23.78
field-weighted impact
References
144
Percentile
100%
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Citations per year
References
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