Extending the Scope of Conceptual Density Functional Theory with Second Order Analytical Methodologies

Bin Wang, Paul Geerlings, Shubin Liu, Frank De Proft

Research output: Contribution to journal › Article › peer-review

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SRP73: SRP-Onderzoekszwaartepunt: Understanding, predicting, and tailoring molecular and material properties and reactivity through combined conceptual and computational quantum chemical approaches
De Proft, F., Tielens, F., Alonso Giner, M. & De Vleeschouwer, F.
1/11/22 → 31/10/27
Project: Fundamental