NEW METHODS IN THE THEORY OF MOLECULES AND SOLIDS p. C3-1 J. C. SLATER DOI: https://doi.org/10.1051/jphyscol:1972301 AbstractPDF (401.5 KB)
STATISTICAL EXCHANGE AND THE HEISENBERG EXCHANGE INTEGRAL p. C3-7 J. C. SLATER DOI: https://doi.org/10.1051/jphyscol:1972302 AbstractPDF (394.5 KB)
CALCULATION OF THE ELECTRONIC STRUCTURE OF SOLIDS IN THE SEVENTIES p. C3-13 F. HERMAN DOI: https://doi.org/10.1051/jphyscol:1972303 AbstractPDF (737.1 KB)
LOCALIZED STATES AND BAND STRUCTURE p. C3-21 F. BASSANI DOI: https://doi.org/10.1051/jphyscol:1972304 AbstractPDF (337.9 KB)
ELECTRONIC STRUCTURE OF SEMICONDUCTORS p. C3-27 J. C. PHILLIPS DOI: https://doi.org/10.1051/jphyscol:1972305 AbstractPDF (286.4 KB)
APPLICATION AND EXTENSIONS OF THE GREEN'S FUNCTION METHOD p. C3-31 B. SEGALL DOI: https://doi.org/10.1051/jphyscol:1972306 AbstractPDF (1.968 MB)
RELATIVISTIC KKR CALCULATIONS ON HEAVY METALS (LEAD) p. C3-39 C. B. SOMMERS, G. JURAS and B. SEGALL DOI: https://doi.org/10.1051/jphyscol:1972307 AbstractPDF (805.1 KB)
SCREENED IONS IN SOLIDS p. C3-49 G. J. MORGAN DOI: https://doi.org/10.1051/jphyscol:1972308 AbstractPDF (454.1 KB)
RELATIVISTIC ELECTRONIC BAND STRUCTURE OF THE HEAVY METALS AND THEIR INTERMETALLIC COMPOUNDS p. C3-57 A. J. FREEMAN and D. D. KOELLING DOI: https://doi.org/10.1051/jphyscol:1972309 AbstractPDF (3.450 MB)
ON LOCAL DENSITY SCHEMES p. C3-73 L. HEDIN and S. LUNDQVIST DOI: https://doi.org/10.1051/jphyscol:1972310 AbstractPDF (1.342 MB)
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 AbstractPDF (405.1 KB)
ELECTRONIC STRUCTURE OF COPPER p. C3-89 A. M. BORING and E. C. SNOW DOI: https://doi.org/10.1051/jphyscol:1972312 AbstractPDF (312.1 KB)
A SIMPLIFIED METHOD FOR COLLECTIVE EXCITATIONS IN REALISTIC SYSTEMS p. C3-95 B. JOHANSSON and G. ARBMAN DOI: https://doi.org/10.1051/jphyscol:1972313 AbstractPDF (1.018 MB)
THE EXACT HARTREE-FOCK PROBLEM FOR LITHIUM CRYSTALS : A PRELIMINARY REPORT p. C3-99 F.E. HARRIS, L. KUMAR and H. J. MONKHORST DOI: https://doi.org/10.1051/jphyscol:1972314 AbstractPDF (210.9 KB)
SURFACE ENERGY AND SURFACE POTENTIALS OF TRANSITION METALS p. C3-103 J. T. WABER, E. KENNARD and YU-PING TSUI DOI: https://doi.org/10.1051/jphyscol:1972315 AbstractPDF (5.996 MB)
A. P. W. HARTREE-FOCK CALCULATIONS IN INSULATING CRYSTALS p. C3-119 F. PERROT DOI: https://doi.org/10.1051/jphyscol:1972316 AbstractPDF (236.2 KB)
APPROXIMATE NON-EMPIRICAL TIGHT-BINDING BAND STRUCTURE CALCULATIONS WITH APPLICATIONS TO DIAMOND AND SILICON p. C3-123 J. LINDERBERG and J. Chr. POULSEN DOI: https://doi.org/10.1051/jphyscol:1972317 AbstractPDF (250.0 KB)
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 and PH. DURAND DOI: https://doi.org/10.1051/jphyscol:1972318 AbstractPDF (730.7 KB)
RELATING THEORY TO EXPERIMENT : THE OPTICAL PROPERTIES OF COPPER p. C3-131 A. R. WILLIAMS, J. F. JANAK and V. L. MORUZZI DOI: https://doi.org/10.1051/jphyscol:1972319 AbstractPDF (1.077 MB)
DEVELOPMENTS OF THE LOCAL APPROXIMATION FOR DISORDERED SYSTEMS p. C3-135 W. KOHN and J. OLSON DOI: https://doi.org/10.1051/jphyscol:1972320 AbstractPDF (570.8 KB)
« LOCALIZED EIGENSTATES IN DISORDERED SYSTEMS » p. C3-145 E. N. ECONOMOU DOI: https://doi.org/10.1051/jphyscol:1972321 AbstractPDF (1.240 MB)
SOME COMPUTATIONAL PROBLEMS OF THE THEORY OF DISORDERED SEMICONDUCTORS p. C3-153 V. L. BONCH-BRUEVICH DOI: https://doi.org/10.1051/jphyscol:1972322 AbstractPDF (283.5 KB)
COMPUTATION OF ε2-SPECTRA OF AMORPHOUS SEMICONDUCTORS p. C3-157 B. KRAMER, K. MASCHKE and P. THOMAS DOI: https://doi.org/10.1051/jphyscol:1972323 AbstractPDF (1.640 MB)
ELECTRONIC STRUCTURE OF DISORDERED SYSTEMS p. C3-167 F. CYROT-LACKMANN DOI: https://doi.org/10.1051/jphyscol:1972324 AbstractPDF (487.7 KB)
APPLICATION OF THE MOMENT'S METHOD TO THE CALCULATION OF THE DENSITY OF STATES OF THE IMPURITY BAND p. C3-175 J. P. GASPARD and F. CYROT-LACKMANN DOI: https://doi.org/10.1051/jphyscol:1972325 AbstractPDF (210.0 KB)
AN « ORBITAL CORRECTION METHOD » FOR SOLID-STATE CALCULATION p. C3-179 W. A. HARRISON DOI: https://doi.org/10.1051/jphyscol:1972326 AbstractPDF (378.9 KB)
ANALYSIS OF ELECTRONIC STRUCTURE USING EMPIRICAL PSEUDOPOTENTIALS p. C3-185 W. VAN HAERINGEN, M. F. H. SCHUURMANS and H.-G. JUNGINGER DOI: https://doi.org/10.1051/jphyscol:1972327 AbstractPDF (958.2 KB)
TRANSITION METAL WAVE FUNCTIONS : A FIRST PRINCIPLES RESONANT TB APPROACH p. C3-191 D. G. PETTIFOR DOI: https://doi.org/10.1051/jphyscol:1972328 AbstractPDF (225.5 KB)
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 AbstractPDF (1.365 MB)
CALCULS DE L'ÉNERGIE DE COHÉSION DU MÉTAL DE LITHIUM p. C3-205 J.-L. CALAIS and G. SPERBER DOI: https://doi.org/10.1051/jphyscol:1972330 AbstractPDF (178.3 KB)
DIFFICULTIES WITH OPEN STRUCTURES p. C3-209 J. M. ZIMAN DOI: https://doi.org/10.1051/jphyscol:1972331 AbstractPDF (372.4 KB)
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 and T. M. HATTOX DOI: https://doi.org/10.1051/jphyscol:1972332 AbstractPDF (618.5 KB)
THE ELECTRONIC BAND STRUCTURE OF V3Ga AND V3Si p. C3-223 I. B. GOLDBERG and M. WEGER DOI: https://doi.org/10.1051/jphyscol:1972333 AbstractPDF (2.702 MB)
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 AbstractPDF (258.2 KB)
THE BAND STRUCTURE PROBLEM IN TERMS OF SCATTERED WAVES p. C3-239 D. A. LIBERMAN DOI: https://doi.org/10.1051/jphyscol:1972335 AbstractPDF (86.02 KB)
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 AbstractPDF (311.3 KB)
ELECTRONIC STRUCTURE OF BINARY SUBSTITUTIONAL ALLOYS p. C3-245 H. EHRENREICH DOI: https://doi.org/10.1051/jphyscol:1972337 AbstractPDF (127.5 KB)
BINARY ALLOYS IN THE STRONG-SCATTERING LIMIT : MOMENT ANALYSIS p. C3-247 S. KIRKPATRICK DOI: https://doi.org/10.1051/jphyscol:1972338 AbstractPDF (263.1 KB)
THE PSEUDOPOTENTIAL THEORY AND THE IMPURITY STATES IN NOBLE AND TRANSITION METALS p. C3-251 C. DEMANGEAT, F. GAUTIER and R. RIEDINGER DOI: https://doi.org/10.1051/jphyscol:1972339 AbstractPDF (523.4 KB)
COPPER-ZINC ALLOYS AS TREATED BY VIRTUAL CRYSTAL AND RELATED APPROXIMATIONS p. C3-259 N. H. MARCH, P. GIBBS, G. M. STOCKS and J. S. FAULKNER DOI: https://doi.org/10.1051/jphyscol:1972340 AbstractPDF (624.2 KB)
CLUSTER EFFECTS IN DISORDERED ALLOYS p. C3-269 F. DUCASTELLE DOI: https://doi.org/10.1051/jphyscol:1972341 AbstractPDF (136.7 KB)
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 AbstractPDF (1.496 MB)
CONSTRUCTION OF AN OPTIMIZED Z-INDEPENDENT STATISTICAL EXCHANGE POTENTIAL FOR ATOMIC, MOLECULAR, AND SOLID STATE CALCULATIONS p. C3-277 K. SCHWARZ and F. HERMAN DOI: https://doi.org/10.1051/jphyscol:1972343 AbstractPDF (420.5 KB)
