Year |
Citation |
Score |
2021 |
Ehteshami H, Ackland G. High Pressure Hydrogen and the Potts Model on a Triangular Lattice. Journal of Physics. Condensed Matter : An Institute of Physics Journal. PMID 34102627 DOI: 10.1088/1361-648X/ac093a |
0.308 |
|
2020 |
Zong H, Wiebe H, Ackland GJ. Understanding high pressure molecular hydrogen with a hierarchical machine-learned potential. Nature Communications. 11: 5014. PMID 33024105 DOI: 10.1038/s41467-020-18788-9 |
0.308 |
|
2019 |
Crain J, Clark SJ, Ackland GJ, Payne MC, Milman V, Hatton PD, Reid BJ. Theoretical study of high-density phases of covalent semiconductors. I. Ab initio treatment. Physical Review. B, Condensed Matter. 49: 5329-5340. PMID 10011485 DOI: 10.1103/Physrevb.49.5329 |
0.355 |
|
2018 |
Bäker M, Rösler J, Hentrich T, Ackland G. Influence of transition group elements on the stability of the δ- and η-phase in nickelbase alloys Modelling and Simulation in Materials Science and Engineering. 26: 15005. DOI: 10.1088/1361-651X/Aa9759 |
0.382 |
|
2016 |
Mendelev MI, Underwood T, Ackland G. Development of an interatomic potential for the simulation of defects, plasticity, and phase transformations in titanium Journal of Chemical Physics. 145: 154102-154102. PMID 27782472 DOI: 10.1063/1.4964654 |
0.409 |
|
2015 |
Underwood TL, Ackland GJ. Lattice-switch Monte Carlo: The fcc - Bcc problem Journal of Physics: Conference Series. 640. DOI: 10.1088/1742-6596/640/1/012030 |
0.403 |
|
2014 |
Ackland G, Magdau IB. Efficacious calculation of Raman spectra in high pressure hydrogen High Pressure Research. 34: 198-204. DOI: 10.1080/08957959.2013.856897 |
0.416 |
|
2012 |
MacLeod SG, Tegner BE, Cynn H, Evans WJ, Proctor JE, McMahon MI, Ackland GJ. Experimental and theoretical study of Ti-6Al-4V to 220 GPa Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.224202 |
0.407 |
|
2012 |
Lane PD, Galloway GJ, Cole RJ, Caffio M, Schaub R, Ackland GJ. Validating molecular dynamics with direct imaging of radiation damage debris Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.094111 |
0.313 |
|
2012 |
Husband RJ, Loa I, Stinton G, Evans SR, Ackland G, McMahon M. The Structure of Eu-III Arxiv: Materials Science. 377: 12030. DOI: 10.1088/1742-6596/377/1/012030 |
0.367 |
|
2011 |
Marqués M, McMahon MI, Gregoryanz E, Hanfland M, Guillaume CL, Pickard CJ, Ackland GJ, Nelmes RJ. Crystal structures of dense lithium: a metal-semiconductor-metal transition. Physical Review Letters. 106: 095502. PMID 21405633 DOI: 10.1103/Physrevlett.106.095502 |
0.421 |
|
2011 |
Ackland G, Klaver TPC, Hepburn D. First principles calculations of defects in unstable crystals: Austenitic iron Mrs Proceedings. 1363. DOI: 10.1557/Opl.2011.1383 |
0.338 |
|
2011 |
Zelazny M, Richardson R, Ackland G. Twinning hierarchy, shape memory, and superelasticity demonstrated by molecular dynamics Physical Review B. 84: 144113. DOI: 10.1103/Physrevb.84.144113 |
0.385 |
|
2009 |
Marqués M, Ackland GJ, Lundegaard LF, Stinton G, Nelmes RJ, McMahon MI, Contreras-García J. Potassium under pressure: a pseudobinary ionic compound. Physical Review Letters. 103: 115501. PMID 19792381 DOI: 10.1103/Physrevlett.103.115501 |
0.389 |
|
2009 |
Lundegaard LF, Marques M, Stinton G, Ackland G, Nelmes R, McMahon M. Observation of the oP8 crystal structure in potassium at high pressure Physical Review B. 80: 20101. DOI: 10.1103/Physrevb.80.020101 |
0.326 |
|
2009 |
Hepburn D, Ackland G, Olsson P. Rescaled potentials for transition metal solutes in α-iron Philosophical Magazine. 89: 3393-3411. DOI: 10.1080/14786430903292381 |
0.305 |
|
2009 |
Marques M, Ackland G, Loveday J. Nature and stability of ice X High Pressure Research. 29: 208-211. DOI: 10.1080/08957950802564031 |
0.351 |
|
2008 |
Marques M, Ackland G, Lundegaard LF, Falconi S, Hejny C, McMahon M, Contreras-Garcia J, Hanfland M. Origin of incommensurate modulations in the high-pressure phosphorus IV phase Physical Review B. 78: 54120. DOI: 10.1103/Physrevb.78.054120 |
0.385 |
|
2007 |
Jackson AN, Ackland G. Lattice-switch Monte Carlo simulation for binary hard-sphere crystals. Physical Review E. 76: 66703-66703. PMID 18233939 DOI: 10.1103/Physreve.76.066703 |
0.394 |
|
2007 |
Mendelev MI, Ackland G. Development of an interatomic potential for the simulation of phase transformations in zirconium Philosophical Magazine Letters. 87: 349-359. DOI: 10.1080/09500830701191393 |
0.45 |
|
2006 |
Falconi S, Ackland G. Ab initio simulations in liquid caesium at high pressure and temperature Physical Review B. 73: 184204. DOI: 10.1103/Physrevb.73.184204 |
0.394 |
|
2005 |
Ackland G, Fox H. Total energy calculation for high pressure selenium: the origin of incommensurate modulations in Se IV and the instability of proposed Se II Journal of Physics: Condensed Matter. 17: 1851-1859. DOI: 10.1088/0953-8984/17/12/009 |
0.423 |
|
2003 |
Mendelev MI, Han S, Srolovitz DJ, Ackland GJ, Sun DY, Asta M. Development of new interatomic potentials appropriate for crystalline and liquid iron Philosophical Magazine. 83: 3977-3994. DOI: 10.1080/14786430310001613264 |
0.336 |
|
2002 |
Ackland G. Devil's staircase in kinetically limited growth. Physical Review E. 66: 41605. PMID 12443214 DOI: 10.1103/Physreve.66.041605 |
0.344 |
|
2002 |
Jackson AN, Bruce AD, Ackland GJ. Lattice-switch Monte Carlo method: application to soft potentials. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 65: 036710. PMID 11909310 DOI: 10.1103/Physreve.65.036710 |
0.377 |
|
2002 |
Drummond ND, Ackland G. Ab initio quasiharmonic equations of state for dynamically stabilized soft-mode materials Physical Review B. 65: 184104. DOI: 10.1103/Physrevb.65.184104 |
0.369 |
|
2002 |
Ackland G. Calculation of free energies from ab initio calculation Journal of Physics: Condensed Matter. 14: 2975-3000. DOI: 10.1088/0953-8984/14/11/311 |
0.349 |
|
2001 |
Ackland G. Two disordered phases of the beta-tin structure in binary semiconductors. Physical Review Letters. 86: 5301-5304. PMID 11384483 DOI: 10.1103/Physrevlett.86.5301 |
0.347 |
|
2001 |
Blackstock JJ, Ackland G. Phase transitions of copper precipitates in Fe–Cu alloys Philosophical Magazine. 81: 2127-2148. DOI: 10.1080/01418610108217139 |
0.419 |
|
2001 |
Ackland GJ, Clark SJ. Ab initio molecular dynamics of liquid carbon disulphide Molecular Physics. 99: 855-863. DOI: 10.1080/00268970010018413 |
0.329 |
|
2001 |
Ackland G. Theory of High Pressure Phases of Group-IV and III–V Semiconductors Physica Status Solidi B-Basic Solid State Physics. 223: 361-368. DOI: 10.1002/1521-3951(200101)223:2<361::Aid-Pssb361>3.0.Co;2-1 |
0.423 |
|
2000 |
Clark SJ, Markwick PRL, Ackland G, Crain J. Short-time reorientational processes in molecular fluids Epl. 49: 34-40. DOI: 10.1209/Epl/I2000-00116-1 |
0.332 |
|
2000 |
Pinsook U, Ackland GJ. Atomistic simulation of shear in a martensitic twinned microstructure Physical Review B. 62: 5427-5434. DOI: 10.1103/Physrevb.62.5427 |
0.597 |
|
2000 |
Kelsey AA, Ackland GJ. Computational analysis of the high-pressure structures of InSb Journal of Physics Condensed Matter. 12: 7161-7173. DOI: 10.1088/0953-8984/12/32/301 |
0.415 |
|
1999 |
Pinsook U, Ackland GJ. Calculation of anomalous phonons and the hcp-bcc phase transition in zirconium Physical Review B. 59: 13642-13649. DOI: 10.1103/Physrevb.59.13642 |
0.661 |
|
1998 |
Clark SJ, Ackland GJ, Crain J. Ab initio molecular polarisabilities of liquid crystals: Application to DOBAMBC and 5CB Europhysics Letters. 44: 578-584. DOI: 10.1209/Epl/I1998-00512-5 |
0.315 |
|
1998 |
Hsueh HC, Chen RK, Vass H, Clark SJ, Ackland G, Poon W, Crain J. Compression Mechanisms In Quasimolecular Xi3 (X=As, Sb, Bi) Solids Physical Review B. 58: 14812-14822. DOI: 10.1103/Physrevb.58.14812 |
0.374 |
|
1998 |
Pinsook U, Ackland GJ. Simulation of martensitic microstructural evolution in zirconium Physical Review B. 58: 11252-11257. DOI: 10.1103/Physrevb.58.11252 |
0.673 |
|
1998 |
Kelsey AA, Ackland G, Clark SJ. Stability And Electronic Structure Of The Cinnabar Phase In Gaas Physical Review B. 57. DOI: 10.1103/Physrevb.57.R2029 |
0.432 |
|
1998 |
Allan D, Kelsey AA, Clark SJ, Angel RJ, Ackland G. High-pressure semiconductor-semimetal transition in TiS2 Physical Review B. 57: 5106-5110. DOI: 10.1103/Physrevb.57.5106 |
0.344 |
|
1997 |
Fuks D, Dorfman S, Ackland G. High-pressure simulations of atom-vacancy solid solution Defect and Diffusion Forum. 143: 161-164. DOI: 10.4028/Www.Scientific.Net/Ddf.143-147.161 |
0.319 |
|
1997 |
Karki B, Stixrude L, Clark S, Warren M, Ackland G, Crain J. Elastic properties of orthorhombic MgSiO3 perovskite at lower mantle pressures American Mineralogist. 82: 635-638. DOI: 10.2138/Am-1997-5-623 |
0.318 |
|
1997 |
Karki BB, Stixrude L, Clark SJ, Warren MC, Ackland G, Crain J. Structure and elasticity of MgO at high pressure American Mineralogist. 82: 51-60. DOI: 10.2138/Am-1997-1-207 |
0.398 |
|
1997 |
Bruce AD, Wilding NB, Ackland GJ. Free energy of crystalline solids: A lattice-switch monte carlo method Physical Review Letters. 79: 3002-3005. DOI: 10.1103/Physrevlett.79.3002 |
0.351 |
|
1997 |
Clark SJ, Ackland G. Ab initio calculations of the self-interstitial in silicon Physical Review B. 56: 47-50. DOI: 10.1103/Physrevb.56.47 |
0.352 |
|
1997 |
Karki B, Warren M, Stixrude L, Ackland G, Crain J. Ab initio studies of high-pressure structural transformations in silica (vol 55, pg 3465, 1997) Physical Review B. 56: 2884-2884. DOI: 10.1103/Physrevb.56.2884 |
0.338 |
|
1997 |
Karki BB, Warren MC, Stixrude L, Ackland G, Crain J. Ab initio studies of high-pressure structural transformations in silica Physical Review B. 55: 3465-3471. DOI: 10.1103/Physrevb.55.3465 |
0.447 |
|
1997 |
Karki BB, Ackland GJ, Crain J. Elastic instabilities in crystals from ab initio stress-strain relations Journal of Physics Condensed Matter. 9: 8579-8589. DOI: 10.1088/0953-8984/9/41/005 |
0.406 |
|
1997 |
Karki BB, Clark SJ, Warren MC, Hsueh HC, Ackland G, Crain J. Ab initio elasticity and lattice dynamics of AgGaSe2 Journal of Physics: Condensed Matter. 9: 375-380. DOI: 10.1088/0953-8984/9/2/005 |
0.329 |
|
1997 |
Clark S, Adam C, Ackland G, Crain J. Conformation energy surface for liquid crystal molecules from first principles : Application to 5CB Molecular Crystals and Liquid Crystals. 299: 39-44. DOI: 10.1080/10587259708041971 |
0.328 |
|
1997 |
Clark S, Adam C, Ackland G, White J, Crain J. Properties of liquid crystal molecules from first principles computer simulation Liquid Crystals. 22: 469-475. DOI: 10.1080/026782997209199 |
0.318 |
|
1997 |
Ackland G, Warren MC. Soft-mode phase transitions from first principles Phase Transitions. 61: 215-223. DOI: 10.1080/01411599708223738 |
0.433 |
|
1996 |
Fuks D, Dorfman S, Ackland G. Pressure-induced thermodynamic properties of atom-vacancy solid solution Physical Review B. 54: 9726-9729. PMID 9984705 DOI: 10.1103/Physrevb.54.9726 |
0.306 |
|
1995 |
Piltz RO, Maclean JR, Clark SJ, Ackland GJ, Hatton PD, Crain J. Structure and properties of silicon XII: A complex tetrahedrally bonded phase. Physical Review. B, Condensed Matter. 52: 4072-4085. PMID 9981533 DOI: 10.1103/Physrevb.52.4072 |
0.331 |
|
1995 |
Crain J, Piltz RO, Ackland GJ, Clark SJ, Payne MC, Milman V, Lin JS, Hatton PD, Nam YH. Erratum: Tetrahedral structures and phase transitions in III-V semiconductors Physical Review. B, Condensed Matter. 52: 16936. PMID 9981104 DOI: 10.1103/Physrevb.52.16936 |
0.384 |
|
1995 |
Clark SJ, Ackland GJ, Crain J. Theoretical stability limit of diamond at ultrahigh pressure Physical Review B. 52: 15035-15038. DOI: 10.1103/Physrevb.52.15035 |
0.403 |
|
1994 |
Crain J, Piltz RO, Ackland GJ, Clark SJ, Payne MC, Milman V, Lin JS, Hatton PD, Nam YH. Tetrahedral structures and phase transitions in III-V semiconductors. Physical Review. B, Condensed Matter. 50: 8389-8401. PMID 9974857 DOI: 10.1103/Physrevb.50.8389 |
0.384 |
|
1993 |
Crain J, Ackland GJ, Piltz RO, Hatton PD. Phase-transition-induced defect formation in III-V semiconductors. Physical Review Letters. 70: 814-817. PMID 10054210 DOI: 10.1103/Physrevlett.70.814 |
0.403 |
|
1993 |
Akbarzadeh H, Clark SJ, Ackland GJ. A theoretical study of selenium I under high pressure Journal of Physics: Condensed Matter. 5: 8065-8074. DOI: 10.1088/0953-8984/5/43/018 |
0.416 |
|
1988 |
Ackland G. Theoretical study of the effect of point defects on the elastic constants of copper Journal of Nuclear Materials. 152: 53-63. DOI: 10.1016/0022-3115(88)90140-7 |
0.344 |
|
1987 |
Ackland G, Thetford R. An improved N-body semi-empirical model for body-centred cubic transition metals Philosophical Magazine. 56: 15-30. DOI: 10.1080/01418618708204464 |
0.364 |
|
1986 |
Ackland G, Finnis MW. Semi-empirical calculation of solid surface tensions in body-centred cubic transition metals Philosophical Magazine. 54: 301-315. DOI: 10.1080/01418618608242900 |
0.304 |
|
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