Supplément au Journal de Physique Colloques

NEW METHODS IN THE THEORY OF MOLECULES AND SOLIDS p. C3-1

J. C. SLATER

DOI: https://doi.org/10.1051/jphyscol:1972301

STATISTICAL EXCHANGE AND THE HEISENBERG EXCHANGE INTEGRAL p. C3-7

J. C. SLATER

DOI: https://doi.org/10.1051/jphyscol:1972302

CALCULATION OF THE ELECTRONIC STRUCTURE OF SOLIDS IN THE SEVENTIES p. C3-13

F. HERMAN

DOI: https://doi.org/10.1051/jphyscol:1972303

LOCALIZED STATES AND BAND STRUCTURE p. C3-21

F. BASSANI

DOI: https://doi.org/10.1051/jphyscol:1972304

ELECTRONIC STRUCTURE OF SEMICONDUCTORS p. C3-27

J. C. PHILLIPS

DOI: https://doi.org/10.1051/jphyscol:1972305

APPLICATION AND EXTENSIONS OF THE GREEN'S FUNCTION METHOD p. C3-31

B. SEGALL

DOI: https://doi.org/10.1051/jphyscol:1972306

RELATIVISTIC KKR CALCULATIONS ON HEAVY METALS (LEAD) p. C3-39

C. B. SOMMERS, G. JURAS et B. SEGALL

DOI: https://doi.org/10.1051/jphyscol:1972307

SCREENED IONS IN SOLIDS p. C3-49

G. J. MORGAN

DOI: https://doi.org/10.1051/jphyscol:1972308

RELATIVISTIC ELECTRONIC BAND STRUCTURE OF THE HEAVY METALS AND THEIR INTERMETALLIC COMPOUNDS p. C3-57

A. J. FREEMAN et D. D. KOELLING

DOI: https://doi.org/10.1051/jphyscol:1972309

ON LOCAL DENSITY SCHEMES p. C3-73

L. HEDIN et S. LUNDQVIST

DOI: https://doi.org/10.1051/jphyscol:1972310

A NEW VARIATIONAL EXPRESSION OF THE EFFECTIVE EXCHANGE AND CORRELATION ENERGY AND RELATED APPROXIMATIONS p. C3-83

L. DAGENS

DOI: https://doi.org/10.1051/jphyscol:1972311

ELECTRONIC STRUCTURE OF COPPER p. C3-89

A. M. BORING et E. C. SNOW

DOI: https://doi.org/10.1051/jphyscol:1972312

A SIMPLIFIED METHOD FOR COLLECTIVE EXCITATIONS IN REALISTIC SYSTEMS p. C3-95

B. JOHANSSON et G. ARBMAN

DOI: https://doi.org/10.1051/jphyscol:1972313

THE EXACT HARTREE-FOCK PROBLEM FOR LITHIUM CRYSTALS : A PRELIMINARY REPORT p. C3-99

F.E. HARRIS, L. KUMAR et H. J. MONKHORST

DOI: https://doi.org/10.1051/jphyscol:1972314

SURFACE ENERGY AND SURFACE POTENTIALS OF TRANSITION METALS p. C3-103

J. T. WABER, E. KENNARD et YU-PING TSUI

DOI: https://doi.org/10.1051/jphyscol:1972315

A. P. W. HARTREE-FOCK CALCULATIONS IN INSULATING CRYSTALS p. C3-119

F. PERROT

DOI: https://doi.org/10.1051/jphyscol:1972316

APPROXIMATE NON-EMPIRICAL TIGHT-BINDING BAND STRUCTURE CALCULATIONS WITH APPLICATIONS TO DIAMOND AND SILICON p. C3-123

J. LINDERBERG et J. Chr. POULSEN

DOI: https://doi.org/10.1051/jphyscol:1972317

ELECTRONIC STRUCTURE OF THE GROUND STATE OF THE COVALENT AND IONIC SOLIDS : USE OF LOCALIZED ORBITALS. APPLICATION TO THE EQUATION OF STATE OF THE DIAMOND p. C3-127

J. GELARD et PH. DURAND

DOI: https://doi.org/10.1051/jphyscol:1972318

RELATING THEORY TO EXPERIMENT : THE OPTICAL PROPERTIES OF COPPER p. C3-131

A. R. WILLIAMS, J. F. JANAK et V. L. MORUZZI

DOI: https://doi.org/10.1051/jphyscol:1972319

DEVELOPMENTS OF THE LOCAL APPROXIMATION FOR DISORDERED SYSTEMS p. C3-135

W. KOHN et J. OLSON

DOI: https://doi.org/10.1051/jphyscol:1972320

« LOCALIZED EIGENSTATES IN DISORDERED SYSTEMS » p. C3-145

E. N. ECONOMOU

DOI: https://doi.org/10.1051/jphyscol:1972321

SOME COMPUTATIONAL PROBLEMS OF THE THEORY OF DISORDERED SEMICONDUCTORS p. C3-153

V. L. BONCH-BRUEVICH

DOI: https://doi.org/10.1051/jphyscol:1972322

COMPUTATION OF ε₂-SPECTRA OF AMORPHOUS SEMICONDUCTORS p. C3-157

B. KRAMER, K. MASCHKE et P. THOMAS

DOI: https://doi.org/10.1051/jphyscol:1972323

ELECTRONIC STRUCTURE OF DISORDERED SYSTEMS p. C3-167

F. CYROT-LACKMANN

DOI: https://doi.org/10.1051/jphyscol:1972324

APPLICATION OF THE MOMENT'S METHOD TO THE CALCULATION OF THE DENSITY OF STATES OF THE IMPURITY BAND p. C3-175

J. P. GASPARD et F. CYROT-LACKMANN

DOI: https://doi.org/10.1051/jphyscol:1972325

AN « ORBITAL CORRECTION METHOD » FOR SOLID-STATE CALCULATION p. C3-179

W. A. HARRISON

DOI: https://doi.org/10.1051/jphyscol:1972326

ANALYSIS OF ELECTRONIC STRUCTURE USING EMPIRICAL PSEUDOPOTENTIALS p. C3-185

W. VAN HAERINGEN, M. F. H. SCHUURMANS et H.-G. JUNGINGER

DOI: https://doi.org/10.1051/jphyscol:1972327

TRANSITION METAL WAVE FUNCTIONS : A FIRST PRINCIPLES RESONANT TB APPROACH p. C3-191

D. G. PETTIFOR

DOI: https://doi.org/10.1051/jphyscol:1972328

CLUSTER MODEL FOR THE ELECTRONIC STRUCTURES OF COMPLEX MOLECULES AND SOLIDS p. C3-195

K. H. JOHNSON

DOI: https://doi.org/10.1051/jphyscol:1972329

CALCULS DE L'ÉNERGIE DE COHÉSION DU MÉTAL DE LITHIUM p. C3-205

J.-L. CALAIS et G. SPERBER

DOI: https://doi.org/10.1051/jphyscol:1972330

DIFFICULTIES WITH OPEN STRUCTURES p. C3-209

J. M. ZIMAN

DOI: https://doi.org/10.1051/jphyscol:1972331

THREE ASPECTS OF THE COMPUTATION OF ELECTRONIC STRUCTURES OF METALS AT THE UNIVERSITY OF FLORIDA : ISOMORPHIC PHASE TRANSITION AND COHESIVE ENERGY IN Cs ; VANADIUM NON-MAGNETIC TO MAGNETIC TRANSITION WITH LATTICE SIZE ; AND SOFT X-RAY EMISSION SPECTRA OF TiC AND NbC p. C3-213

J. B. CONKLIN, Jr. F. W. AVERILL et T. M. HATTOX

DOI: https://doi.org/10.1051/jphyscol:1972332

THE ELECTRONIC BAND STRUCTURE OF V₃Ga AND V₃Si p. C3-223

I. B. GOLDBERG et M. WEGER

DOI: https://doi.org/10.1051/jphyscol:1972333

SOME IMPLICATIONS OF BLOCH ELECTRONS IN THE NUCLEAR QUADRUPOLE INTERACTION IN METALS p. C3-235

Y. FUKAI

DOI: https://doi.org/10.1051/jphyscol:1972334

THE BAND STRUCTURE PROBLEM IN TERMS OF SCATTERED WAVES p. C3-239

D. A. LIBERMAN

DOI: https://doi.org/10.1051/jphyscol:1972335

THE USE OF CLUSTERS OF ATOMS IN THE CALCULATION OF ELECTRONIC STRUCTURES p. C3-241

J. KELLER

DOI: https://doi.org/10.1051/jphyscol:1972336

ELECTRONIC STRUCTURE OF BINARY SUBSTITUTIONAL ALLOYS p. C3-245

H. EHRENREICH

DOI: https://doi.org/10.1051/jphyscol:1972337

BINARY ALLOYS IN THE STRONG-SCATTERING LIMIT : MOMENT ANALYSIS p. C3-247

S. KIRKPATRICK

DOI: https://doi.org/10.1051/jphyscol:1972338

THE PSEUDOPOTENTIAL THEORY AND THE IMPURITY STATES IN NOBLE AND TRANSITION METALS p. C3-251

C. DEMANGEAT, F. GAUTIER et R. RIEDINGER

DOI: https://doi.org/10.1051/jphyscol:1972339

COPPER-ZINC ALLOYS AS TREATED BY VIRTUAL CRYSTAL AND RELATED APPROXIMATIONS p. C3-259

N. H. MARCH, P. GIBBS, G. M. STOCKS et J. S. FAULKNER

DOI: https://doi.org/10.1051/jphyscol:1972340

CLUSTER EFFECTS IN DISORDERED ALLOYS p. C3-269

F. DUCASTELLE

DOI: https://doi.org/10.1051/jphyscol:1972341

A PSEUDOPOTENTIAL APPROACH TO THE ELECTRONIC STRUCTURE OF III-IV LAYER-COMPOUNDS p. C3-273

M. SCHLÜTER

DOI: https://doi.org/10.1051/jphyscol:1972342

CONSTRUCTION OF AN OPTIMIZED Z-INDEPENDENT STATISTICAL EXCHANGE POTENTIAL FOR ATOMIC, MOLECULAR, AND SOLID STATE CALCULATIONS p. C3-277

K. SCHWARZ et F. HERMAN

DOI: https://doi.org/10.1051/jphyscol:1972343

Le Journal de Physique Colloques

Volume 33 / Numéro C3 (Mai-Juin 1972)

"PERSPECTIVES DE CALCUL DE LA STRUCTURE ÉLECTRONIQUE DES SOLIDES ORDONNÉS ET DÉSORDONNÉS"