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Pauling's Conceptions of Hybridization and Resonance in Modern Quantum Chemistry
| Content Provider | MDPI |
|---|---|
| Author | Glendening, Eric Weinhold, Frank |
| Copyright Year | 2021 |
| Description | We employ the tools of natural bond orbital (NBO) and natural resonance theory (NRT) analysis to demonstrate the robustness, consistency, and accuracy with which Linus Pauling’s qualitative conceptions of directional hybridization and resonance delocalization are manifested in all known variants of modern computational quantum chemistry methodology. |
| Starting Page | 4110 |
| e-ISSN | 14203049 |
| DOI | 10.3390/molecules26144110 |
| Journal | Molecules |
| Issue Number | 14 |
| Volume Number | 26 |
| Language | English |
| Publisher | MDPI |
| Publisher Date | 2021-07-06 |
| Access Restriction | Open |
| Subject Keyword | Molecules Atomic, Molecular and Chemical Physics Chemical Bonding Directed Hybridization Resonance Delocalization Mesomerism Natural Bond Orbitals Natural Resonance Theory |
| Content Type | Text |
| Resource Type | Article |