Which Ab Initio Wave Function Methods Are Adequate for Quantitative Calculations of the Energies of Biradicals? The Performance of Coupled-Cluster and Multi-Reference Methods Along a Single-Bond Dissociation Coordinate
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| Description | scientific article published on 19 December 2012 |
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author: William H. Green Donald Truhlar |
| Publication date | December 19, 2012 |
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