nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Ab initio pseudopotential calculations of total energies and forces for hydrogen in palladium
|
Elsässer, C. |
|
1991 |
172 |
1-2 |
p. 217-224 8 p. |
artikel |
2 |
A calculation of correlation functions based on band structure
|
Winter, H. |
|
1991 |
172 |
1-2 |
p. 271-278 8 p. |
artikel |
3 |
A fast full-potential LCAO method for total-energy minimizations
|
Oppeneer, P.M. |
|
1991 |
172 |
1-2 |
p. 195-201 7 p. |
artikel |
4 |
A fully relativistic study of angle-resolved photoemission from Ag (1 0 0) and Au (1 0 0) surfaces
|
König, U. |
|
1991 |
172 |
1-2 |
p. 125-133 9 p. |
artikel |
5 |
All-electron first-principles supercell total-energy calculation of the vacancy formation energy in aluminium
|
Mehl, M.J. |
|
1991 |
172 |
1-2 |
p. 211-215 5 p. |
artikel |
6 |
A new approach to a non-local density functional for the calculation of electron correlation energies
|
Sommers, C. |
|
1991 |
172 |
1-2 |
p. 27-30 4 p. |
artikel |
7 |
A relativistic spin-polarised band theoretical study of magnetic properties of nickel and iron
|
Guo, G.Y. |
|
1991 |
172 |
1-2 |
p. 61-69 9 p. |
artikel |
8 |
A self-consistent surface-Green-function (SSGF) method
|
Scheffler, M. |
|
1991 |
172 |
1-2 |
p. 143-153 11 p. |
artikel |
9 |
Charge and spin fluctuations in the density functional theory
|
Györffy, B.L. |
|
1991 |
172 |
1-2 |
p. 35-43 9 p. |
artikel |
10 |
Charge transfer, charge tailing, cohesion and electron promotion in the transition metals.
|
Watson, R.E. |
|
1991 |
172 |
1-2 |
p. 289-298 10 p. |
artikel |
11 |
Computation of electronic structure of clean and adatom-covered Ag (0 0 1) surfaces by means of TB-LMTO and recursion method
|
Hergert, W. |
|
1991 |
172 |
1-2 |
p. 167-173 7 p. |
artikel |
12 |
Contents
|
|
|
1991 |
172 |
1-2 |
p. ix-xi nvt p. |
artikel |
13 |
Density functional study of iron(II)-porphine
|
Delley, B. |
|
1991 |
172 |
1-2 |
p. 185-193 9 p. |
artikel |
14 |
DGauss - a density functional method for molecular and electronic structure calculations in the 1990s
|
Andzelm, J. |
|
1991 |
172 |
1-2 |
p. 307-317 11 p. |
artikel |
15 |
Editorial Board
|
|
|
1991 |
172 |
1-2 |
p. IFC- 1 p. |
artikel |
16 |
Electronic band structure and chemical bonding in the transition metal dioxides
|
Gubanov, V.A. |
|
1991 |
172 |
1-2 |
p. 285-288 4 p. |
artikel |
17 |
Electronic structure and electron-phonon coupling in high-Tc superconductors
|
Jarlborg, T. |
|
1991 |
172 |
1-2 |
p. 245-251 7 p. |
artikel |
18 |
Electronic structure of ferromagnetic rare-earth-transition-metal compounds
|
Richter, Manuel |
|
1991 |
172 |
1-2 |
p. 85-93 9 p. |
artikel |
19 |
Estimation of the ideal fracture strength for the jellium model within density functional theory and rigorous theorems for bijellic interfaces
|
Ziesche, P. |
|
1991 |
172 |
1-2 |
p. 299-306 8 p. |
artikel |
20 |
Excitations in a generalized density functional theory
|
Fritsche, L. |
|
1991 |
172 |
1-2 |
p. 7-17 11 p. |
artikel |
21 |
f-Electron systems: pushing band theory
|
Koelling, D.D. |
|
1991 |
172 |
1-2 |
p. 117-123 7 p. |
artikel |
22 |
First principles theory of magnetocrystalline anisotropy
|
Strange, P. |
|
1991 |
172 |
1-2 |
p. 51-59 9 p. |
artikel |
23 |
Full-potential LMTO calculations for atomic relaxations at semiconductor-semiconductor interfaces
|
Methfessel, M. |
|
1991 |
172 |
1-2 |
p. 175-183 9 p. |
artikel |
24 |
Generalized gradient approximations for exchange and correlation: A look backward and forward
|
Perdew, John P. |
|
1991 |
172 |
1-2 |
p. 1-6 6 p. |
artikel |
25 |
Half-metallic magnetism in the 1990s
|
de Groot, Robert A. |
|
1991 |
172 |
1-2 |
p. 45-50 6 p. |
artikel |
26 |
List of contributors
|
|
|
1991 |
172 |
1-2 |
p. xiii- 1 p. |
artikel |
27 |
Measurement of the de Haas-van Alphen effect in YBa2Cu3O6.97 using megagauss fields
|
Mueller, F.M. |
|
1991 |
172 |
1-2 |
p. 253-260 8 p. |
artikel |
28 |
New phases of the magnetic elements
|
Arrott, A.S. |
|
1991 |
172 |
1-2 |
p. 31-34 4 p. |
artikel |
29 |
On the failure of the LSD to describe the antiferromagnetic ground state of La2CuO4
|
Temmerman, W.M. |
|
1991 |
172 |
1-2 |
p. 279-283 5 p. |
artikel |
30 |
Orbital magnetism in energy bands
|
Johansson, Börje |
|
1991 |
172 |
1-2 |
p. 101-116 16 p. |
artikel |
31 |
Oscillatory gap superconductivity
|
Weger, M. |
|
1991 |
172 |
1-2 |
p. 261-270 10 p. |
artikel |
32 |
Potential-shape effects in SPLEED from ferromagnets
|
Krewer, J.W. |
|
1991 |
172 |
1-2 |
p. 135-141 7 p. |
artikel |
33 |
Preface
|
Harmon, Bruce |
|
1991 |
172 |
1-2 |
p. vii- 1 p. |
artikel |
34 |
Rare-earth transition-metal intermetallics
|
Brooks, M.S.S. |
|
1991 |
172 |
1-2 |
p. 95-100 6 p. |
artikel |
35 |
Self-consistent surface electronic structure for semi-infinite semiconductors from scattering theory
|
Krüger, P. |
|
1991 |
172 |
1-2 |
p. 155-166 12 p. |
artikel |
36 |
Self-interaction correction of localized bands within the LMTO-ASA band structure method
|
Szotek, Z. |
|
1991 |
172 |
1-2 |
p. 19-25 7 p. |
artikel |
37 |
Spin-orbit effects in the band structure of Bi2Sr2Ca1Cu2O8
|
Hörmandinger, G. |
|
1991 |
172 |
1-2 |
p. 237-243 7 p. |
artikel |
38 |
Spin-polarized relativistic band structure calculations and their application to the magnetic x-ray dichrosim
|
Ebert, H. |
|
1991 |
172 |
1-2 |
p. 71-77 7 p. |
artikel |
39 |
Spin waves and Heisenberg exchange constants for α-iron
|
Köhler, H. |
|
1991 |
172 |
1-2 |
p. 79-84 6 p. |
artikel |
40 |
Structural defects in polymers
|
Springborg, Michael |
|
1991 |
172 |
1-2 |
p. 225-235 11 p. |
artikel |
41 |
Subject index
|
|
|
1991 |
172 |
1-2 |
p. xiv-xvii nvt p. |
artikel |
42 |
To Art Freeman for his 60th birthday
|
Peter, Martin |
|
1991 |
172 |
1-2 |
p. viii- 1 p. |
artikel |
43 |
Total-energy calculations for point defects in metals
|
Dederichs, P.H. |
|
1991 |
172 |
1-2 |
p. 203-209 7 p. |
artikel |