Williams, J. Z., & Yang, W. (2025). Data and scripts from: Correcting Delocalization Error in Materials with Localized Orbitals and Linear-Response Screening. Duke Research Data Repository. https://doi.org/10.7924/r4vq36h9r
Franz, K. J., Bontreger, L. J., Gallo, A. D., Moon, J., Silinski, P., & Monson, E. (2025). Data from: Intramolecular histidine crosslinks formed via copper-catalyzed oxidation of histatin peptides. Duke Research Data Repository. https://doi.org/10.7924/r4nv9q11m.
Williams J., Marszalek P., & Yang W. (2024). Data from: Computed isotope shifts of high-frequency vibrational modes exceed thermal noise in propionate bound to a human olfactory receptor. Duke Research Data Repository. https://doi.org/10.7924/r4ng4wb8d
Chen, Z., & Yang, W. (2023). Data and scripts from: Development of a machine-learning finite-range nonlocal density functional. Duke Research Data Repository. https://doi.org/10.7924/r4fj2p230
Wang, S., Hu, Y., Kouznetsova, T. B., Sapir, L., Chen, D., Herzog-Arbeitman, A., Johnson, J. A., Rubinstein, M., & Craig, S. L. (2023). Data from: Facile Mechanochemical Cycloreversion of Polymer Cross-linkers Enhances Tear Resistance. Duke Research Data Repository. https://doi.org/10.7924/r43r1215n
Folena, G., Biroli, G., Charbonneau, P., Hu, Y., Zamponi, F. (2022). Data from: Equilibrium fluctuations in mean-field disordered models. Duke Research Data Repository. https://doi.org/10.7924/r42f7w487
Mahler, A., Williams, J.Z., Su, N.Q., Yang, W. (2022): Data and scripts from: Localized orbital scaling correction for periodic systems. Duke Research Data Repository. https://doi.org/10.7924/r4s75hv98
Zhang, Y., Wang, Z., Kouznetsova, T., Sha, Y., Xu, E., Shannahan, L., Fermen-Coker, M., Lin., Y. (2020). Data from: Distal conformational locks on ferrocene mechanophores guide reaction pathways for increased mechanochemical reactivity. V3 Duke Research Data Repository. https://doi.org/10.7924/r4gq6z428
Lin, Y., Kouznetsova, T., Chang, C., & Craig, S. (2020). Data from: Enhanced polymer mechanical degradation through mechanochemically unveiled lactonization. Duke Research Data Repository. V2 https://doi.org/10.7924/r4fq9x365
