M. Asta
M. Asta
University of California, Sandia National Laboratories, Northwestern University
Verified email at berkeley.edu
Title
Cited by
Cited by
Year
Development of new interatomic potentials appropriate for crystalline and liquid iron
MI Mendelev, S Han, DJ Srolovitz, GJ Ackland, DY Sun, M Asta
Philosophical magazine 83 (35), 3977-3994, 2003
11502003
The alloy theoretic automated toolkit: A user guide
A van de Walle, M Asta, G Ceder
arXiv preprint cond-mat/0212159, 2002
8862002
Surface reconstruction and chemical evolution of stoichiometric layered cathode materials for lithium-ion batteries
F Lin, IM Markus, D Nordlund, TC Weng, MD Asta, HL Xin, MM Doeff
Nature communications 5 (1), 1-9, 2014
7622014
Solidification microstructures and solid-state parallels: Recent developments, future directions
M Asta, C Beckermann, A Karma, W Kurz, R Napolitano, M Plapp, ...
Acta Materialia 57 (4), 941-971, 2009
6142009
Lead‐free halide perovskite solar cells with high photocurrents realized through vacancy modulation
MH Kumar, S Dharani, WL Leong, PP Boix, RR Prabhakar, T Baikie, C Shi, ...
Advanced Materials 26 (41), 7122-7127, 2014
5842014
Method for computing the anisotropy of the solid-liquid interfacial free energy
JJ Hoyt, M Asta, A Karma
Physical review letters 86 (24), 5530, 2001
4512001
Efficient stochastic generation of special quasirandom structures
A Van de Walle, P Tiwary, M De Jong, DL Olmsted, M Asta, A Dick, D Shin, ...
Calphad 42, 13-18, 2013
4322013
Atomistic modeling of interfaces and their impact on microstructure and properties
Y Mishin, M Asta, J Li
Acta Materialia 58 (4), 1117-1151, 2010
4182010
Lead-free germanium iodide perovskite materials for photovoltaic applications
T Krishnamoorthy, H Ding, C Yan, WL Leong, T Baikie, Z Zhang, ...
Journal of Materials Chemistry A 3 (47), 23829-23832, 2015
3942015
First-principles theory of ionic diffusion with nondilute carriers
A Van der Ven, G Ceder, M Asta, PD Tepesch
Physical Review B 64 (18), 184307, 2001
3882001
Charting the complete elastic properties of inorganic crystalline compounds
M De Jong, W Chen, T Angsten, A Jain, R Notestine, A Gamst, M Sluiter, ...
Scientific data 2 (1), 1-13, 2015
3872015
Atomistic and continuum modeling of dendritic solidification
JJ Hoyt, M Asta, A Karma
Materials Science and Engineering: R: Reports 41 (6), 121-163, 2003
3842003
The structure and chemistry of the TiO 2-rich surface of SrTiO 3 (001)
N Erdman, KR Poeppelmeier, M Asta, O Warschkow, DE Ellis, LD Marks
Nature 419 (6902), 55-58, 2002
3732002
Crystal-melt interfacial free energies in hcp metals: A molecular dynamics study of Mg
DY Sun, MI Mendelev, CA Becker, K Kudin, T Haxhimali, M Asta, JJ Hoyt, ...
Physical Review B 73 (2), 024116, 2006
3532006
Analysis of semi-empirical interatomic potentials appropriate for simulation of crystalline and liquid Al and Cu
MI Mendelev, MJ Kramer, CA Becker, M Asta
Philosophical Magazine 88 (12), 1723-1750, 2008
3382008
Hydrogen in aluminum: First-principles calculations of structure and thermodynamics
C Wolverton, V Ozoliņš, M Asta
Physical Review B 69 (14), 144109, 2004
3342004
A combined experimental− computational investigation of carbon dioxide capture in a series of isoreticular zeolitic imidazolate frameworks
W Morris, B Leung, H Furukawa, OK Yaghi, N He, H Hayashi, ...
Journal of the American Chemical Society 132 (32), 11006-11008, 2010
2872010
Self-driven lattice-model Monte Carlo simulations of alloy thermodynamic properties and phase diagrams
A van de Walle, M Asta
Modelling and Simulation in Materials Science and Engineering 10 (5), 521, 2002
2832002
Low-temperature long-range oxygen order in YBa2Cu3Oz
D De Fontaine, G Ceder, M Asta
Nature 343 (6258), 544-546, 1990
2451990
Structural phase transformations in metallic grain boundaries
T Frolov, DL Olmsted, M Asta, Y Mishin
Nature communications 4 (1), 1-7, 2013
2072013
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Articles 1–20