Multiconfiguration Pair-Density Functional Theory Predicts Spin-State Ordering in Iron Complexes with the Same Accuracy as Complete Active Space Second-Order Perturbation Theory at a Significantly Reduced Computational Cost
| Image |  |
|---|---|
| Description | scientific article published on 24 April 2017 |
| Author/s |
author: Ilaria Ciofini Pragya Verma Donald Truhlar Liam Wilbraham Laura Gagliardi |
| Publication date | April 24, 2017 |
| Language | |
| Country of origin | |
| Wikipedia link | |
| Copyright status | |
| Missing/wrong data? | Edit Wikidata item |