High-precision sampling for Brillouin-zone integration in metals M Methfessel, AT Paxton
physical review B 40 (6), 3616, 1989
8203 1989 A stabilization mechanism of zirconia based on oxygen vacancies only S Fabris, AT Paxton, MW Finnis
Acta Materialia 50 (20), 5171-5178, 2002
526 2002 Chain-Fragment Doping and the Phase Diagram of YBa 2 Cu 3 O 7− x J Zaanen, AT Paxton, O Jepsen, OK Andersen
Physical review letters 60 (25), 2685, 1988
235 1988 Bismuth embrittlement of copper is an atomic size effect R Schweinfest, AT Paxton, MW Finnis
Nature 432 (7020), 1008-1011, 2004
214 2004 Electronic structure of reduced titanium dioxide AT Paxton, L Thiên-Nga
Physical Review B 57 (3), 1579, 1998
212 1998 Structural energy-volume relations in first-row transition metals AT Paxton, M Methfessel, HM Polatoglou
Physical Review B 41 (12), 8127, 1990
209 1990 reconstructions: First-principles calculations of surface energy and atomic structure compared with scanning tunneling microscopy imagesK Johnston, MR Castell, AT Paxton, MW Finnis
Physical Review B—Condensed Matter and Materials Physics 70 (8), 085415, 2004
206 2004 Structural and chemical embrittlement of grain boundaries by impurities: A general theory and first-principles calculations for copper AY Lozovoi, AT Paxton, MW Finnis
Physical Review B—Condensed Matter and Materials Physics 74 (15), 155416, 2006
167 2006 Crystal structures of zirconia from first principles and self-consistent tight binding MW Finnis, AT Paxton, M Methfessel, M van Schilfgaarde
Physical review letters 81 (23), 5149, 1998
155 1998 A quantum mechanical calculation of the theoretical strength of metals AT Paxton, P Gumbsch, M Methfessel
Philosophical magazine letters 63 (5), 267-274, 1991
154 1991 First-principles determination of the Ni-Al phase diagram A Pasturel, C Colinet, AT Paxton, M Van Schilfgaarde
Journal of Physics: Condensed Matter 4 (4), 945, 1992
112 1992 Relative energetics and structural properties of zirconia using a self-consistent tight-binding model S Fabris, AT Paxton, MW Finnis
Physical Review B 61 (10), 6617, 2000
106 2000 Electronic structure and phase stability study in the Ni-Ti system A Pasturel, C Colinet, DN Manh, AT Paxton, M Van Schilfgaarde
Physical Review B 52 (21), 15176, 1995
105 1995 Free energy and molecular dynamics calculations for the cubic-tetragonal phase transition in zirconia S Fabris, AT Paxton, MW Finnis
Physical Review B 63 (9), 094101, 2001
95 2001 What can be learned about highTc from local density theory? J Zaanen, O Jepsen, O Gunnarsson, AT Paxton, OK Andersen, A Svane
Physica C: Superconductivity 153, 1636-1641, 1988
94 1988 Hydrogen embrittlement I. Analysis of hydrogen-enhanced localized plasticity: Effect of hydrogen on the velocity of screw dislocations in -Fe IH Katzarov, DL Pashov, AT Paxton
Physical Review Materials 1 (3), 033602, 2017
92 2017 Boron in copper: A perfect misfit in the bulk and cohesion enhancer at a grain boundary AY Lozovoi, AT Paxton
Physical Review B—Condensed Matter and Materials Physics 77 (16), 165413, 2008
92 2008 A bandstructure view of the Hume-Rothery electron phases AT Paxton, M Methfessel, DG Pettifor
Proceedings of the Royal Society of London. Series A: Mathematical, Physical …, 1997
91 1997 Evidences of transitory metastable phases in refractory metals solidified from highly undercooled liquids in a drop tube L Cortella, B Vinet, PJ Desré, A Pasturel, AT Paxton, M Van Schilfgaarde
Physical review letters 70 (10), 1469, 1993
89 1993 Energization of the transport systems for arabinose and comparison with galactose transport in Escherichia coli KR Daruwalla, AT Paxton, PJF Henderson
Biochemical Journal 200 (3), 611-627, 1981
88 1981