Rignanese GM - 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: rignanese gm. 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. Among authors: rignanese gm. 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: rignanese gm. 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

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: rignanese gm. Phys Chem Chem Phys. 2017 Mar 1;19(9):6743-6756. doi: 10.1039/c7cp00437k. Phys Chem Chem Phys. 2017. PMID: 28211934

5

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: rignanese gm. Sci Data. 2017 Jul 4;4:170085. doi: 10.1038/sdata.2017.85. Sci Data. 2017. PMID: 28675382 Free PMC article.

6

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: rignanese gm. Sci Data. 2018 May 1;5:180065. doi: 10.1038/sdata.2018.65. Sci Data. 2018. PMID: 29714723 Free PMC article.

7

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: rignanese gm. 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.

8

ChemEnv: a fast and robust coordination environment identification tool.

Waroquiers D, George J, Horton M, Schenk S, Persson KA, Rignanese GM, Gonze X, Hautier G. Waroquiers D, et al. Among authors: rignanese gm. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2020 Aug 1;76(Pt 4):683-695. doi: 10.1107/S2052520620007994. Epub 2020 Jul 21. Acta Crystallogr B Struct Sci Cryst Eng Mater. 2020. PMID: 32831287 Free PMC article.

9

Electron-Phonon beyond Fröhlich: Dynamical Quadrupoles in Polar and Covalent Solids.

Brunin G, Miranda HPC, Giantomassi M, Royo M, Stengel M, Verstraete MJ, Gonze X, Rignanese GM, Hautier G. Brunin G, et al. Among authors: rignanese gm. Phys Rev Lett. 2020 Sep 25;125(13):136601. doi: 10.1103/PhysRevLett.125.136601. Phys Rev Lett. 2020. PMID: 33034486 Free article.

10

Discovery of multivalley Fermi surface responsible for the high thermoelectric performance in Yb₁₄MnSb₁₁ and Yb₁₄MgSb₁₁.

Perez CJ, Wood M, Ricci F, Yu G, Vo T, Bux SK, Hautier G, Rignanese GM, Snyder GJ, Kauzlarich SM. Perez CJ, et al. Among authors: rignanese gm. Sci Adv. 2021 Jan 20;7(4):eabe9439. doi: 10.1126/sciadv.abe9439. Print 2021 Jan. Sci Adv. 2021. PMID: 33523935 Free PMC article.

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