Anomalous Structural Response in Porous Framework Materials

Status	Finished
Effective start/end date	1/11/22 → 30/04/26

Mapping structure-property relationships in a 6-oxo-verdazyl radical by variable pressure crystallography and density functional theory
Brookes, J. R., Kumar, V. J., Jones, I. M., Summers, A. M., Bird, S. A., Low, P. J., Moggach, S. A. & Spagnoli, D., Aug 2026, In: Acta crystallographica Section B, Structural science, crystal engineering and materials. 82, 4, p. 416-432 17 p.
Research output: Contribution to journal › Article › peer-review

Open Access
Assessing the accuracy of DFT functionals and ab initio methods for the description of multireference verdazyl radical crystalline interactions
Brookes, J. R., Watson, P. D., Wild, D. A., Moggach, S. A. & Spagnoli, D., 14 Nov 2025, In: Physical Chemistry Chemical Physics. 27, 42, p. 22480-22507 28 p.
Research output: Contribution to journal › Article › peer-review

Open Access
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High-Pressure Co-Crystallization of Acetonitrile and Trimethylacetonitrile
Blake, R. M., Bird, S. A., Brookes, J. R., Jones, I. M., Maynard-Casely, H. E., Riboldi-Tunnicliffe, A., Stapleton, N. D., Turner, G. F., Williamson, R. M., Young, R. J., Spagnoli, D. & Moggach, S. A., 20 Aug 2025, In: Crystal Growth & Design. 25, 16, p. 6620-6627 8 p.
Research output: Contribution to journal › Article › peer-review

Open Access
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