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Results: 1-13 |
Results: 13
An ab initio study of the structure and properties of aluminum hydroxide: Gibbsite and bayerite
Authors: Gale, JD Rohl, AL Milman, V Warren, MC
Citation: Jd. Gale et al., An ab initio study of the structure and properties of aluminum hydroxide: Gibbsite and bayerite, J PHYS CH B, 105(42), 2001, pp. 10236-10242
Elastic properties of TiB2 and MgB2
Authors: Milman, V Warren, MC
Citation: V. Milman et Mc. Warren, Elastic properties of TiB2 and MgB2, J PHYS-COND, 13(24), 2001, pp. 5585-5595
Elasticity of hexagonal BeO
Authors: Milman, V Warren, MC
Citation: V. Milman et Mc. Warren, Elasticity of hexagonal BeO, J PHYS-COND, 13(2), 2001, pp. 241-251
Computational study of tetrahedral Al-Si ordering in muscovite
Authors: Palin, EJ Dove, MT Redfern, SAT Bosenick, A Sainz-Diaz, CI Warren, MC
Citation: Ej. Palin et al., Computational study of tetrahedral Al-Si ordering in muscovite, PHYS CHEM M, 28(8), 2001, pp. 534-544
Calculation of the elastic constants of the Al2SiO5 polymorphs andalusite,sillimanite and kyanite
Authors: Winkler, B Hytha, M Warren, MC Milman, V Gale, JD Schreuer, J
Citation: B. Winkler et al., Calculation of the elastic constants of the Al2SiO5 polymorphs andalusite,sillimanite and kyanite, Z KRISTALL, 216(2), 2001, pp. 67-70
Computational methods for the study of energies of cation distributions: applications to cation-ordering phase transitions and solid solutions
Authors: Bosenick, A Dove, MT Myers, ER Palin, EJ Sainz-Diaz, CI Guiton, BS Warren, MC Craig, MS Redfern, SAT
Citation: A. Bosenick et al., Computational methods for the study of energies of cation distributions: applications to cation-ordering phase transitions and solid solutions, MINERAL MAG, 65(2), 2001, pp. 193-219
Monte Carlo methods for the study of cation ordering in minerals
Authors: Warren, MC Dove, MT Myers, ER Bosenick, A Palin, EJ Sainz-Diaz, CI Guiton, BS Redfern, SAT
Citation: Mc. Warren et al., Monte Carlo methods for the study of cation ordering in minerals, MINERAL MAG, 65(2), 2001, pp. 221-248
Ab initio simulations of cation ordering in oxides: application to spinel
Authors: Warren, MC Dove, MT Redfern, SAT
Citation: Mc. Warren et al., Ab initio simulations of cation ordering in oxides: application to spinel, J PHYS-COND, 12(4), 2000, pp. L43-L48
Oxidative stress-induced apoptosis of endothelial cells
Authors: Warren, MC Bump, EA Medeiros, D Braunhut, SJ
Citation: Mc. Warren et al., Oxidative stress-induced apoptosis of endothelial cells, FREE RAD B, 29(6), 2000, pp. 537-547
Modelling in relation to cation ordering
Authors: Dove, MT Bosenick, A Myers, ER Warren, MC Redfern, SAT
Citation: Mt. Dove et al., Modelling in relation to cation ordering, PHASE TRAN, 71(3), 2000, pp. 205-226
Amorphous silica from the Rigid Unit Mode approach
Authors: Dove, MT Hammonds, KD Harris, MJ Heine, V Keen, DA Pryde, AKA Trachenko, K Warren, MC
Citation: Mt. Dove et al., Amorphous silica from the Rigid Unit Mode approach, MINERAL MAG, 64(3), 2000, pp. 377-388
Disordering of MgAl2O4 spinel from first principles
Authors: Warren, MC Dove, MT Redfern, SAT
Citation: Mc. Warren et al., Disordering of MgAl2O4 spinel from first principles, MINERAL MAG, 64(2), 2000, pp. 311-317
Change from sixfold to fivefold coordination of silicate polyhedra: Insights from first-principles calculations of CaSi2O5
Authors: Warren, MC Redfern, SAT Angel, R
Citation: Mc. Warren et al., Change from sixfold to fivefold coordination of silicate polyhedra: Insights from first-principles calculations of CaSi2O5, PHYS REV B, 59(14), 1999, pp. 9149-9154
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