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                             43 gevonden resultaten
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
                             43 gevonden resultaten
 
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