Materials data infrastructure: a case study of the citrination platform to examine data import, storage, and access J O’Mara, B Meredig, K Michel
Jom 68 (8), 2031-2034, 2016
121 2016 Beyond bulk single crystals: a data format for all materials structure–property–processing relationships K Michel, B Meredig
Mrs Bulletin 41, 617-623, 2016
42 2016 Determining dilute-limit solvus boundaries in multi-component systems using defect energetics: Na in PbTe and PbS JW Doak, KJ Michel, C Wolverton
Journal of Materials Chemistry C 3 (40), 10630-10649, 2015
36 2015 First-Principles Study of the Li− Mg− N− H System: Compound Structures and Hydrogen-Storage Properties KJ Michel, AR Akbarzadeh, V Ozolins
The Journal of Physical Chemistry C 113 (32), 14551-14558, 2009
36 2009 Vacancy Diffusion in NaAlH4 and Na3 AlH6 KJ Michel, V Ozoliņš
The Journal of Physical Chemistry C 115 (43), 21465-21472, 2011
34 2011 Native Defect Concentrations in NaAlH4 and Na3 AlH6 KJ Michel, V Ozoliņš
The Journal of Physical Chemistry C 115 (43), 21443-21453, 2011
31 2011 Automated crystal structure solution from powder diffraction data: Validation of the first-principles-assisted structure solution method L Ward, K Michel, C Wolverton
Physical Review Materials 1 (6), 063802, 2017
26 2017 First-principles computational discovery of materials for hydrogen storage V Ozolins, AR Akbarzadeh, H Gunaydin, K Michel, C Wolverton, ...
Journal of Physics: Conference Series 180 (1), 012076, 2009
26 2009 Stability and conductivity of cation- and anion-substituted Z Yao, S Kim, K Michel, Y Zhang, M Aykol, C Wolverton
Physical Review Materials 2 (6), 065402, 2018
24 2018 Site Substitution of Ti in NaAlH4 and Na3 AlH6 KJ Michel, V Ozoliņš
The Journal of Physical Chemistry C 115 (43), 21454-21464, 2011
24 2011 Thermodynamic measurements of sub-milligram bulk samples using a membrane-based “calorimeter on a chip” DW Cooke, KJ Michel, F Hellman
24 2008 Symmetry building Monte Carlo-based crystal structure prediction KJ Michel, C Wolverton
Computer Physics Communications 185 (5), 1389-1393, 2014
23 2014 Recent advances in the theory of hydrogen storage in complex metal hydrides KJ Michel, V Ozoliņš
MRS bulletin 38 (6), 462-472, 2013
23 2013 Atomic structure and K Michel, Y Liu, V Ozolins
Physical Review B—Condensed Matter and Materials Physics 82 (17), 174103, 2010
19 2010 Fast Mass Transport Kinetics in B20 H16 : A High-Capacity Hydrogen Storage Material KJ Michel, Y Zhang, C Wolverton
The Journal of Physical Chemistry C 117 (38), 19295-19301, 2013
16 2013 Theory of mass transport in sodium alanate KJ Michel, V Ozolins
Journal of Materials Chemistry A 2 (12), 4438-4448, 2014
15 2014 Thermodynamic stability of transition metals on the Mg-terminated Y Wang, K Michel, Y Zhang, C Wolverton
Physical Review B 91 (15), 155431, 2015
12 2015 First-principles insight into the degeneracy of ground-state LiBH Y Zhang, Y Wang, K Michel, C Wolverton
Physical Review B—Condensed Matter and Materials Physics 86 (9), 094111, 2012
12 2012 Three new crystal structures in the Na–Pb system: solving structures without additional experimental input L Ward, K Michel, C Wolverton
Acta Crystallographica Section A: Foundations and Advances 71 (5), 542-548, 2015
9 2015 Hydrogen diffusion in bulk MgB2 Y Wang, K Michel, C Wolverton
Scripta Materialia 117, 86-91, 2016
8 2016