Phil Hasnip
Cited by
Cited by
First-principles simulation: ideas, illustrations and the CASTEP code
MD Segall, PJD Lindan, MJ Probert, CJ Pickard, PJ Hasnip, SJ Clark, ...
Journal of physics: condensed matter 14 (11), 2717, 2002
First principles methods using CASTEP
SJ Clark, MD Segall, CJ Pickard, PJ Hasnip, MIJ Probert, K Refson, ...
Zeitschrift für Kristallographie-Crystalline Materials 220 (5-6), 567-570, 2005
Reproducibility in density functional theory calculations of solids
K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ...
Science 351 (6280), 2016
Density functional theory in the solid state
PJ Hasnip, K Refson, MIJ Probert, JR Yates, SJ Clark, CJ Pickard
Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2014
Electron and vibrational spectroscopies using DFT, plane waves and pseudopotentials: CASTEP implementation
V Milman, K Refson, SJ Clark, CJ Pickard, JR Yates, SP Gao, PJ Hasnip, ...
Journal of Molecular Structure: THEOCHEM 954 (1-3), 22-35, 2010
Materials studio CASTEP, version 2.2
M Segall, P Linda, M Probert, C Pickard, P Hasnip, S Clark, M Payne
Accelrys: San Diego, CA, 2002
Electronic energy minimisation with ultrasoft pseudopotentials
PJ Hasnip, CJ Pickard
Computer physics communications 174 (1), 24-29, 2006
Exchange coupling and magnetic anisotropy at Fe/FePt interfaces
CJ Aas, PJ Hasnip, R Cuadrado, EM Plotnikova, L Szunyogh, L Udvardi, ...
Physical Review B 88 (17), 174409, 2013
Ab initio studies of disorder in the full Heusler alloy Co2FexMn1−xSi
PJ Hasnip, JH Smith, VK Lazarov
Journal of Applied Physics 113 (17), 17B106, 2013
Dynamically stabilized growth of polar oxides: the case of MgO (111)
VK Lazarov, Z Cai, K Yoshida, KHL Zhang, M Weinert, KS Ziemer, ...
Physical review letters 107 (5), 056101, 2011
DL_MG: A parallel multigrid Poisson and Poisson–Boltzmann solver for electronic structure calculations in vacuum and solution
JC Womack, L Anton, J Dziedzic, PJ Hasnip, MIJ Probert, CK Skylaris
Journal of chemical theory and computation 14 (3), 1412-1432, 2018
Realisation of magnetically and atomically abrupt half-metal/semiconductor interface: Co2FeSi0.5Al0.5/Ge(111)
Z Nedelkoski, B Kuerbanjiang, SE Glover, AM Sanchez, D Kepaptsoglou, ...
Scientific reports 6, 37282, 2016
The effect of film and interface structure on the transport properties of Heusler based current-perpendicular-to-plane spin valves
VK Lazarov, K Yoshida, J Sato, PJ Hasnip, M Oogane, A Hirohata, Y Ando
Applied Physics Letters 98 (24), 242508, 2011
The role of chemical structure on the magnetic and electronic properties of Co2FeAl0.5Si0.5/Si(111) interface
B Kuerbanjiang, Z Nedelkoski, D Kepaptsoglou, A Ghasemi, SE Glover, ...
Applied Physics Letters 108 (17), 172412, 2016
The effect of atomic structure on interface spin-polarization of half-metallic spin valves: Co2MnSi/Ag epitaxial interfaces
Z Nedelkoski, PJ Hasnip, AM Sanchez, B Kuerbanjiang, E Higgins, ...
Applied Physics Letters 107 (21), 212404, 2015
Tailoring the electrical properties of Ge/GaAs by film deposition rate and preparation of fully compensated Ge films
VF Mitin, VK Lazarov, PM Lytvyn, PJ Hasnip, VV Kholevchuk, ...
Physical Review B 84 (12), 125316, 2011
Computing the self-consistent field in Kohn–Sham density functional theory
ND Woods, MC Payne, PJ Hasnip
Journal of Physics: Condensed Matter 31 (45), 453001, 2019
Correlation between spin transport signal and Heusler/semiconductor interface quality in lateral spin-valve devices
B Kuerbanjiang, Y Fujita, M Yamada, S Yamada, AM Sanchez, PJ Hasnip, ...
Physical Review B 98 (11), 115304, 2018
Structure of naturally hydrated ferrihydrite revealed through neutron diffraction and first-principles modeling
HF Chappell, W Thom, DT Bowron, N Faria, PJ Hasnip, JJ Powell
Physical Review Materials 1 (3), 036002, 2017
Experimental and density functional study of Mn doped Bi2Te3 topological insulator
A Ghasemi, D Kepaptsoglou, AI Figueroa, GA Naydenov, PJ Hasnip, ...
APL Materials 4 (12), 126103, 2016
The system can't perform the operation now. Try again later.
Articles 1–20