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Hydrogen-bonded diketopyrrolopyrrole (DPP) pigments as organic semiconductors.
Głowacki ED, Coskun H, Blood-Forsythe MA, Monkowius U, Leonat L, Grzybowski M, Gryko D, White MS, Aspuru-Guzik A, Sariciftci NS. Głowacki ED, et al. Org Electron. 2014 Dec;15(12):3521-3528. doi: 10.1016/j.orgel.2014.09.038. Org Electron. 2014. PMID: 25642158 Free PMC article.
Design of efficient molecular organic light-emitting diodes by a high-throughput virtual screening and experimental approach.
Gómez-Bombarelli R, Aguilera-Iparraguirre J, Hirzel TD, Duvenaud D, Maclaurin D, Blood-Forsythe MA, Chae HS, Einzinger M, Ha DG, Wu T, Markopoulos G, Jeon S, Kang H, Miyazaki H, Numata M, Kim S, Huang W, Hong SI, Baldo M, Adams RP, Aspuru-Guzik A. Gómez-Bombarelli R, et al. Nat Mater. 2016 Oct;15(10):1120-7. doi: 10.1038/nmat4717. Epub 2016 Aug 8. Nat Mater. 2016. PMID: 27500805
The Harvard organic photovoltaic dataset.
Lopez SA, Pyzer-Knapp EO, Simm GN, Lutzow T, Li K, Seress LR, Hachmann J, Aspuru-Guzik A. Lopez SA, et al. Sci Data. 2016 Sep 27;3:160086. doi: 10.1038/sdata.2016.86. Sci Data. 2016. PMID: 27676312 Free PMC article.
Simulating chemistry using quantum computers.
Kassal I, Whitfield JD, Perdomo-Ortiz A, Yung MH, Aspuru-Guzik A. Kassal I, et al. Annu Rev Phys Chem. 2011;62:185-207. doi: 10.1146/annurev-physchem-032210-103512. Annu Rev Phys Chem. 2011. PMID: 21166541
265 results