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- Currently displaying 181 - 200 of 214 publications
Localisation of adsorbate-induced demagnetisation: CO chemisorbed on Ni{110}
Chemical Physics Letters
(2000)
327
125
Pentaprismane and hypostrophene from first-principles, with plane waves
Chemical Physics Letters
(2000)
317
381
Adsorbate/substrate bonding in Co{10 1 0}/K-c( 2×2 ) elucidated through first-principles theory
Chemical Physics Letters
(2000)
317
372
Characterization of theGe(001)/Si−(2×1)surface using lattice dynamics
Physical Review B Condensed Matter and Materials Physics
(1999)
60
10648
(doi: 10.1103/PhysRevB.60.10648)
First-principles theoretical studies of the structural, electronic and magnetic properties of Co{10(1)over-bar-0}-A
Chemical Physics Letters
(1999)
309
434
Theoretical evidence concerning mixed dimer growth on the surface
Journal of Physics Condensed Matter
(1999)
8
6641
(doi: 10.1088/0953-8984/8/36/016)
Comparative ab initio pseudopotential studies of group V overlayers on Si(001)
Journal of Physics: Condensed Matter
(1999)
10
7751
(doi: 10.1088/0953-8984/10/35/009)
An ab initio pseudopotential calculation of ground-state and excited-state properties of gallium nitride
Journal of Physics: Condensed Matter
(1999)
6
8781
(doi: 10.1088/0953-8984/6/42/010)
Vibrational properties of Ge- and Sb-adsorbed Si(001) surfaces
Physical Review B
(1998)
58
10754
(doi: 10.1103/physrevb.58.10754)
Ab-initio density functional calculations for Si(001)/Bi(1 ML)-(2 × 1)
Surface Science
(1998)
404
641
Structure and stability of the Si(001) c(4×4)-Sb surface
Physical Review B Condensed Matter and Materials Physics
(1998)
57
R12701
(doi: 10.1103/physrevb.57.r12701)
Ab initio calculation of geometry and bonding for overlaid and inlaid models of Si(001)/Sb(0.25ML)-c(4×4)
Surface Science
(1998)
404
645
A study of atomic vibrations on Si(001)/Sb(2 × 1)
Surface Science
(1998)
402-404
42
Structure and energetics of segregated and nonsegregated Ge(001)/Si(2x1)
Physical Review B
(1998)
57
8794
(doi: 10.1103/physrevb.57.8794)
Thermodynamic evidence for surfactant behaviour of Sb in the growth of Ge on Si(001)
Surface Science
(1998)
398
L308
Atomic geometry, electronic structure, and vibrational properties of the Ge(001)(1) surface
Physical Review B
(1998)
57
4649
(doi: 10.1103/PhysRevB.57.4649)
Atomic structure of a monolayer of Ge on Si(001)(2 × 1)
Surface Review and Letters
(1998)
5
97
(doi: 10.1142/S0218625X98000207)
Structural studies of Si(001)/Sb(0.25 ML)-c(4 × 4)
Applied Surface Science
(1998)
123-124
48
A study of atomic vibrations on Si(001)(2x1)-Ge
Applied Surface Science
(1998)
123-124
151
