Dholabhai PP - Search Results

1

Structure and segregation of dopant-defect complexes at grain boundaries in nanocrystalline doped ceria.

Dholabhai PP, Aguiar JA, Wu L, Holesinger TG, Aoki T, Castro RH, Uberuaga BP. Dholabhai PP, et al. Phys Chem Chem Phys. 2015 Jun 21;17(23):15375-85. doi: 10.1039/c5cp02200b. Phys Chem Chem Phys. 2015. PMID: 26000664

2

Defect interactions with stepped CeO₂/SrTiO₃ interfaces: implications for radiation damage evolution and fast ion conduction.

Dholabhai PP, Aguiar JA, Misra A, Uberuaga BP. Dholabhai PP, et al. J Chem Phys. 2014 May 21;140(19):194701. doi: 10.1063/1.4876225. J Chem Phys. 2014. PMID: 24852551

3

The role of surfaces, chemical interfaces, and disorder on plutonium incorporation in pyrochlores.

Perriot R, Dholabhai PP, Uberuaga BP. Perriot R, et al. Among authors: dholabhai pp. Phys Chem Chem Phys. 2016 Aug 17;18(33):22852-63. doi: 10.1039/c6cp03543d. Phys Chem Chem Phys. 2016. PMID: 27480791

4

On the mobility of carriers at semi-coherent oxide heterointerfaces.

Dholabhai PP, Martínez E, Brown NT, Uberuaga BP. Dholabhai PP, et al. Phys Chem Chem Phys. 2017 Aug 30;19(34):23122-23130. doi: 10.1039/c7cp04884j. Phys Chem Chem Phys. 2017. PMID: 28820196

5

Point defect-grain boundary interactions in MgO: an atomistic study.

Uberuaga BP, Bai XM, Dholabhai PP, Moore N, Duffy DM. Uberuaga BP, et al. Among authors: dholabhai pp. J Phys Condens Matter. 2013 Sep 4;25(35):355001. doi: 10.1088/0953-8984/25/35/355001. Epub 2013 Jul 17. J Phys Condens Matter. 2013. PMID: 23860398

6

Termination chemistry-driven dislocation structure at SrTiO3/MgO heterointerfaces.

Dholabhai PP, Pilania G, Aguiar JA, Misra A, Uberuaga BP. Dholabhai PP, et al. Nat Commun. 2014 Sep 23;5:5043. doi: 10.1038/ncomms6043. Nat Commun. 2014. PMID: 25247885 Free article.

7

Disorder-induced transition from grain boundary to bulk dominated ionic diffusion in pyrochlores.

Perriot R, Dholabhai PP, Uberuaga BP. Perriot R, et al. Among authors: dholabhai pp. Nanoscale. 2017 May 25;9(20):6826-6836. doi: 10.1039/c7nr01373f. Nanoscale. 2017. PMID: 28497819

8

A density functional study of defect migration in gadolinium doped ceria.

Dholabhai PP, Adams JB, Crozier P, Sharma R. Dholabhai PP, et al. Phys Chem Chem Phys. 2010 Jul 28;12(28):7904-10. doi: 10.1039/b924534k. Epub 2010 May 26. Phys Chem Chem Phys. 2010. PMID: 20502831

9

Atomic-scale structure of misfit dislocations in CeO₂/MgO heterostructures and thermodynamic stability of dopant-defect complexes at the heterointerface.

Dholabhai PP. Dholabhai PP. Phys Chem Chem Phys. 2019 Oct 7;21(37):20878-20891. doi: 10.1039/c9cp03727f. Epub 2019 Sep 13. Phys Chem Chem Phys. 2019. PMID: 31517361

10

Electronic structure and quantum dynamics of photoinitiated dissociation of O2 on rutile TiO2 nanocluster.

Dholabhai PP, Yu HG. Dholabhai PP, et al. J Chem Phys. 2013 May 21;138(19):194705. doi: 10.1063/1.4805000. J Chem Phys. 2013. PMID: 23697428

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