Hautier G - Search Results

1

Amorphization mechanism of SrIrO₃ electrocatalyst: How oxygen redox initiates ionic diffusion and structural reorganization.

Wan G, Freeland JW, Kloppenburg J, Petretto G, Nelson JN, Kuo DY, Sun CJ, Wen J, Diulus JT, Herman GS, Dong Y, Kou R, Sun J, Chen S, Shen KM, Schlom DG, Rignanese GM, Hautier G, Fong DD, Feng Z, Zhou H, Suntivich J. Wan G, et al. Among authors: hautier g. Sci Adv. 2021 Jan 8;7(2):eabc7323. doi: 10.1126/sciadv.abc7323. Print 2021 Jan. Sci Adv. 2021. PMID: 33523986 Free PMC article.

2

Identification and design principles of low hole effective mass p-type transparent conducting oxides.

Hautier G, Miglio A, Ceder G, Rignanese GM, Gonze X. Hautier G, et al. Nat Commun. 2013;4:2292. doi: 10.1038/ncomms3292. Nat Commun. 2013. PMID: 23939205 Free PMC article.

3

Low-dimensional transport and large thermoelectric power factors in bulk semiconductors by band engineering of highly directional electronic states.

Bilc DI, Hautier G, Waroquiers D, Rignanese GM, Ghosez P. Bilc DI, et al. Among authors: hautier g. Phys Rev Lett. 2015 Apr 3;114(13):136601. doi: 10.1103/PhysRevLett.114.136601. Epub 2015 Mar 31. Phys Rev Lett. 2015. PMID: 25884131 Free article.

4

Influence of Surface Adsorption on the Oxygen Evolution Reaction on IrO₂(110).

Kuo DY, Kawasaki JK, Nelson JN, Kloppenburg J, Hautier G, Shen KM, Schlom DG, Suntivich J. Kuo DY, et al. Among authors: hautier g. J Am Chem Soc. 2017 Mar 8;139(9):3473-3479. doi: 10.1021/jacs.6b11932. Epub 2017 Feb 21. J Am Chem Soc. 2017. PMID: 28181433

5

A computational assessment of the electronic, thermoelectric, and defect properties of bournonite (CuPbSbS₃) and related substitutions.

Faghaninia A, Yu G, Aydemir U, Wood M, Chen W, Rignanese GM, Snyder GJ, Hautier G, Jain A. Faghaninia A, et al. Among authors: hautier g. Phys Chem Chem Phys. 2017 Mar 1;19(9):6743-6756. doi: 10.1039/c7cp00437k. Phys Chem Chem Phys. 2017. PMID: 28211934 Free article.

6

An ab initio electronic transport database for inorganic materials.

Ricci F, Chen W, Aydemir U, Snyder GJ, Rignanese GM, Jain A, Hautier G. Ricci F, et al. Among authors: hautier g. Sci Data. 2017 Jul 4;4:170085. doi: 10.1038/sdata.2017.85. Sci Data. 2017. PMID: 28675382 Free PMC article.

7

High-throughput density-functional perturbation theory phonons for inorganic materials.

Petretto G, Dwaraknath S, P C Miranda H, Winston D, Giantomassi M, van Setten MJ, Gonze X, Persson KA, Hautier G, Rignanese GM. Petretto G, et al. Among authors: hautier g. Sci Data. 2018 May 1;5:180065. doi: 10.1038/sdata.2018.65. Sci Data. 2018. PMID: 29714723 Free PMC article.

8

Measurements of Oxygen Electroadsorption Energies and Oxygen Evolution Reaction on RuO₂(110): A Discussion of the Sabatier Principle and Its Role in Electrocatalysis.

Kuo DY, Paik H, Kloppenburg J, Faeth B, Shen KM, Schlom DG, Hautier G, Suntivich J. Kuo DY, et al. Among authors: hautier g. J Am Chem Soc. 2018 Dec 19;140(50):17597-17605. doi: 10.1021/jacs.8b09657. Epub 2018 Dec 10. J Am Chem Soc. 2018. PMID: 30463402

9

Sr₃CrN₃: A New Electride with a Partially Filled d-Shell Transition Metal.

Chanhom P, Fritz KE, Burton LA, Kloppenburg J, Filinchuk Y, Senyshyn A, Wang M, Feng Z, Insin N, Suntivich J, Hautier G. Chanhom P, et al. Among authors: hautier g. J Am Chem Soc. 2019 Jul 10;141(27):10595-10598. doi: 10.1021/jacs.9b03472. Epub 2019 Jun 28. J Am Chem Soc. 2019. PMID: 31251610

10

The Limited Predictive Power of the Pauling Rules.

George J, Waroquiers D, Di Stefano D, Petretto G, Rignanese GM, Hautier G. George J, et al. Among authors: hautier g. Angew Chem Int Ed Engl. 2020 May 4;59(19):7569-7575. doi: 10.1002/anie.202000829. Epub 2020 Mar 20. Angew Chem Int Ed Engl. 2020. PMID: 32065708 Free PMC article.

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