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LibreCat: https://research-explorer.ista.ac.at/record/12938
DOI: 10.1039/d2cp03921d
PMID: 36254856

Reinhardt A, Pickard CJ, Cheng B. Predicting the phase diagram of titanium dioxide with random search and pattern recognition. Physical Chemistry Chemical Physics. 2020;22(22):12697-12705. doi:10.1039/d0cp02513e
LibreCat: https://research-explorer.ista.ac.at/record/9666
DOI: 10.1039/d0cp02513e
PMID: 32459228
arXiv: 1909.08934

Cheng B, Dellago C, Ceriotti M. Theoretical prediction of the homogeneous ice nucleation rate: Disentangling thermodynamics and kinetics. Physical Chemistry Chemical Physics. 2018;20(45):28732-28740. doi:10.1039/c8cp04561e
LibreCat: https://research-explorer.ista.ac.at/record/9668
DOI: 10.1039/c8cp04561e
PMID: 30412211
arXiv: 1807.05551

Sari A, Hrenar T, Malis M, Dosli N. Quantum mechanical study of secondary structure formation in protected dipeptides. Physical Chemistry Chemical Physics. 2010;12(18):4678-4685. doi:10.1039/b923041f
LibreCat: https://research-explorer.ista.ac.at/record/10128
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