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Tzitzeklis, Christos A, Gupta, Jyoti K, Dyer, Matthew S 
ORCID: 0000-0002-4923-3003, Manning, Troy D ORCID: 0000-0002-7624-4306, Pitcher, Michael J ORCID: 0000-0003-2044-6774, Niu, Hongjun J, Savvin, Rstanislav, Alaria, Jonathan ORCID: 0000-0001-5868-0318, Darling, George R ORCID: 0000-0001-9329-9993, Claridge, John B ORCID: 0000-0003-4849-6714 et al (show 1 more authors)
(2018)
Computational Prediction and Experimental Realization of p-Type Carriers in the Wide-Band-Gap Oxide SrZn<sub>1-<i>x</i></sub>Li<i><sub>x</sub></i>O<sub>2</sub>.
INORGANIC CHEMISTRY, 57 (19).
pp. 11874-11883.
Chang, Tzu-Chien, Lu, Yi-Ting ORCID: 0000-0003-2128-1385, Lee, Chih-Heng, Gupta, Jyoti K, Hardwick, Laurence J ORCID: 0000-0001-8796-685X, Hu, Chi-Chang and Chen, Hsin-Yi Tiffany
(2021)
The Effect of Degrees of Inversion on the Electronic Structure of Spinel NiCo2O4: A Density Functional Theory Study.
ACS Omega, 6 (14).
pp. 9692-9699.
Gupta, Jyoti K, Adams, Dave J and Berry, Neil G ORCID: 0000-0003-1928-0738
(2016)
Will it gel? Successful computational prediction of peptide gelators using physicochemical properties and molecular fingerprints.
CHEMICAL SCIENCE, 7 (7).
pp. 4713-4719.