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La ricerca find articoli where authors phrase all words ' Papaconstantopoulos, DA' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 45 riferimenti
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    1. Bacalis, NC; Papaconstantopoulos, DA; Mehl, MJ; Lach-Hab, M
      Transferable tight-binding parameters for ferromagnetic and paramagnetic iron

      PHYSICA B
    2. Papaconstantopoulos, DA; Lach-Hab, M; Mehl, MJ
      Tight-binding Hamiltonians for realistic electronic structure calculations

      PHYSICA B
    3. Papaconstantopoulos, DA; Mehl, MJ
      Precise tight-binding description of the band structure of MgB2 - art. no.172510

      PHYSICAL REVIEW B
    4. Mehl, MJ; Papaconstantopoulos, DA; Singh, DJ
      Effects of C, Cu, and Be substitutions in superconducting MgB2 - art. no. 140509

      PHYSICAL REVIEW B
    5. Mishin, Y; Mehl, MJ; Papaconstantopoulos, DA; Voter, AF; Kress, JD
      Structural stability and lattice defects in copper: Ab initio, tight-binding, and embedded-atom calculations - art. no. 224106

      PHYSICAL REVIEW B
    6. Kirchhoff, F; Mehl, MJ; Papanicolaou, NI; Papaconstantopoulos, DA; Khan, FS
      Dynamical properties of Au from tight-binding molecular-dynamics simulations - art. no. 195101

      PHYSICAL REVIEW B
    7. Lekka, CE; Papanicolaou, NI; Evangelakis, GA; Papaconstantopoulos, DA
      Transferability of Slater-Koster parameters

      JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
    8. Mehl, MJ; Papaconstantopoulos, DA; Mazin, II; Bacalis, NC; Pickett, WE
      Applications of the NRL tight-binding method to magnetic systems

      JOURNAL OF APPLIED PHYSICS
    9. Papaconstantopoulos, DA; Mazin, II; Hathaway, KB
      Stabilization of itinerant (band) magnetism in FeAl by Ga substitution forAl

      JOURNAL OF APPLIED PHYSICS
    10. Mazin, II; Papaconstantopoulos, DA; Singh, DJ
      Tight-binding Hamiltonians for Sr-filled ruthenates: Application to the gap anisotropy and Hall coefficient in Sr2RuO4

      PHYSICAL REVIEW B
    11. Mehl, MJ; Papaconstantopoulos, DA; Kioussis, N; Herbranson, M
      Tight-binding study of stacking fault energies and the Rice criterion of ductility in the fcc metals

      PHYSICAL REVIEW B
    12. Papanicolaou, NI; Kallinteris, GC; Evangelakis, GA; Papaconstantopoulos, DA
      Second-moment interatomic potential for aluminum derived from total-energycalculations and molecular dynamics application

      COMPUTATIONAL MATERIALS SCIENCE
    13. Bernstein, N; Mehl, MJ; Papaconstantopoulos, DA; Papanicolaou, NI; Bazant, MZ; Kaxiras, E
      Energetic, vibrational, and electronic properties of silicon using a nonorthogonal tight-binding model

      PHYSICAL REVIEW B
    14. Lach-hab, M; Keegan, M; Papaconstantopoulos, DA; Mehl, MJ
      Electronic structure calculations of PbTe

      JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
    15. Ardelean, H; Belin-Ferre, E; Senemaud, C; Papaconstantopoulos, DA
      Calculation of the densities of states of a-Si1-yCy(: H) alloys and comparison with measured X-ray spectra

      JOURNAL OF NON-CRYSTALLINE SOLIDS
    16. Papaconstantopoulos, DA; Hathaway, KB
      Predictions of magnetism in transition metal aluminides

      JOURNAL OF APPLIED PHYSICS
    17. Fournee, V; Mazin, I; Papaconstantopoulos, DA; Belin-Ferre, E
      Electronic structure calculations of Al-Cu alloys: comparison with experimental results on Hume-Rothery phases

      PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICSELECTRONIC OPTICAL AND MAGNETIC PROPERTIES
    18. Canto, G; de Coss, R; Papaconstantopoulos, DA
      Electronic local density of states for the TiNi(001) surface

      SURFACE REVIEW AND LETTERS
    19. Jimenez, VM; Lassaletta, G; Fernandez, A; Espinos, JP; Yubero, F; Gonzalez-Elipe, AR; Soriano, L; Sanz, JM; Papaconstantopoulos, DA
      Resonant photoemission characterization of SnO

      PHYSICAL REVIEW B-CONDENSED MATTER
    20. Mishin, Y; Farkas, D; Mehl, MJ; Papaconstantopoulos, DA
      Interatomic potentials for monoatomic metals from experimental data and abinitio calculations

      PHYSICAL REVIEW B-CONDENSED MATTER
    21. Gross, A; Scheffler, M; Mehl, MJ; Papaconstantopoulos, DA
      Ab initio based tight-binding hamiltonian for the dissociation of molecules at surfaces

      PHYSICAL REVIEW LETTERS
    22. Papanicolaou, NI; Kallinteris, GC; Evangelakis, GA; Papaconstantopoulos, DA; Mehl, MJ
      Second-moment interatomic potential for Cu-Au alloys based on total-energycalculations and its application to molecular-dynamics simulations

      JOURNAL OF PHYSICS-CONDENSED MATTER
    23. YANG SH; MEHL MJ; PAPACONSTANTOPOULOS DA
      APPLICATION OF A TIGHT-BINDING TOTAL-ENERGY METHOD FOR AL, GA, AND IN

      Physical review. B, Condensed matter
    24. LI YB; BLAISTENBAROJAS E; PAPACONSTANTOPOULOS DA
      STRUCTURE AND DYNAMICS OF ALKALI-METAL CLUSTERS AND FISSION OF HIGHLY-CHARGED CLUSTERS

      Physical review. B, Condensed matter
    25. PAPACONSTANTOPOULOS DA; PICKETT WE
      TIGHT-BINDING COHERENT-POTENTIAL APPROXIMATION STUDY OF FERROMAGNETICLA2 3BA1/3MNO3/

      Physical review. B, Condensed matter
    26. Sigalas, MM; Rose, JH; Papaconstantopoulos, DA; Shore, HB
      Scaling lengths of elemental metals

      PHYSICAL REVIEW B-CONDENSED MATTER
    27. PAPACONSTANTOPOULOS DA; MEHL MJ
      THE TIGHT-BINDING METHOD FOR INTERPOLATING FIRST-PRINCIPLES TOTAL-ENERGY RESULTS

      Journal of phase equilibria
    28. BACALIS NC; ANAGNOSTOPOULOS GF; PAPANICOLAOU NI; PAPACONSTANTOPOULOS DA
      ELECTRONIC-STRUCTURE OF ORDERED AND DISORDERED CU-AG ALLOYS

      Physical review. B, Condensed matter
    29. KALLINTERIS GC; PAPANICOLAOU NI; EVANGELAKIS GA; PAPACONSTANTOPOULOS DA
      TIGHT-BINDING INTERATOMIC POTENTIALS BASED ON TOTAL-ENERGY CALCULATION - APPLICATION TO NOBLE-METALS USING MOLECULAR-DYNAMICS SIMULATION

      Physical review. B, Condensed matter
    30. BACALIS NC; THEODORAKOPOULOS N; PAPACONSTANTOPOULOS DA
      WAVE-VECTOR-DEPENDENT STONER APPROACH TO BAND FERROMAGNETISM IN NI

      Physical review. B, Condensed matter
    31. LI YB; BLAISTENBAROJAS E; PAPACONSTANTOPOULOS DA
      MOLECULAR-DYNAMICS STUDY OF NEUTRAL AND MULTIPLY-CHARGED SODIUM CLUSTERS

      Chemical physics letters
    32. GHEORGHIU A; SENEMAUD C; BELINFERRE E; DANKHAZI Z; MAGAUDMARTINAGE L; PAPACONSTANTOPOULOS DA
      COMPARISON OF THEORETICAL AND EXPERIMENTAL ELECTRONIC DISTRIBUTIONS OF SI-NI AND SI-ER ALLOYS

      Journal of physics. Condensed matter
    33. MEHL MJ; PAPACONSTANTOPOULOS DA
      APPLICATIONS OF A TIGHT-BINDING TOTAL-ENERGY METHOD FOR TRANSITION AND NOBLE-METALS - ELASTIC-CONSTANTS, VACANCIES, AND SURFACES OF MONATOMIC METALS

      Physical review. B, Condensed matter
    34. MEHL MJ; PAPACONSTANTOPOULOS DA
      APPLICATION OF A NEW TIGHT-BINDING METHOD FOR TRANSITION-METALS - MANGANESE

      Europhysics letters
    35. MEHL MJ; PAPACONSTANTOPOULOS DA; COHEN RE
      A TIGHT-BINDING METHOD FOR THE EVALUATION OF THE TOTAL-ENERGY OF LARGE SYSTEMS

      International journal of thermophysics
    36. DELAISSARDIERE GT; DANKHAZI Z; BELIN E; SADOC A; DUC NM; MAYOU D; KEEGAN MA; PAPACONSTANTOPOULOS DA
      EXPERIMENTAL AND THEORETICAL ELECTRONIC DISTRIBUTIONS IN AL-CU-BASED ALLOYS

      Physical review. B, Condensed matter
    37. KEEGAN MA; PAPACONSTANTOPOULOS DA
      ELECTRONIC-STRUCTURE AND TOTAL-ENERGY CALCULATIONS BY A SEMI-SELF-CONSISTENT AUGMENTED-PLANE-WAVE METHOD

      Physical review. B, Condensed matter
    38. JULIEN JP; PAPACONSTANTOPOULOS DA; SINGH DJ; PICKETT WE; CYROTLACKMANN F
      ELECTRONIC-STRUCTURE OF THE BAA1-XBXO3(A,B=PB,BI,SN,SB) ALLOY SYSTEMS- IMPLICATIONS FOR SUPERCONDUCTIVITY

      Physica. C, Superconductivity
    39. PICKETT WE; PAPACONSTANTOPOULOS DA; PEDERSON MR; ERWIN SC
      ELECTRON-PHONON COUPLING IN A3C60 - CONTRIBUTIONS FROM INTERMOLECULARMODES

      Journal of superconductivity
    40. COHEN RE; MEHL MJ; PAPACONSTANTOPOULOS DA
      TIGHT-BINDING TOTAL-ENERGY METHOD FOR TRANSITION AND NOBLE-METALS

      Physical review. B, Condensed matter
    41. SIGALAS MM; PAPACONSTANTOPOULOS DA
      CALCULATIONS OF THE TOTAL-ENERGY, ELECTRON-PHONON INTERACTION, AND STONER PARAMETER FOR METALS

      Physical review. B, Condensed matter
    42. SIGALAS MM; PAPACONSTANTOPOULOS DA
      TRANSFERABLE TOTAL-ENERGY PARAMETRIZATION FOR METALS - APPLICATIONS TO ELASTIC-CONSTANT DETERMINATION

      Physical review. B, Condensed matter
    43. SINGH DJ; PAPACONSTANTOPOULOS DA
      MAGNETIC AND ELECTRONIC-STRUCTURE OF COH

      Physical review. B, Condensed matter
    44. KEEGAN MA; SKROCH J; PAPACONSTANTOPOULOS DA
      ANALYTIC EXPRESSIONS OF BAND-STRUCTURE POTENTIALS AND TRANSFERABILITYSTUDIES

      Modelling and simulation in materials science and engineering
    45. MEHL MJ; SINGH DJ; PAPACONSTANTOPOULOS DA
      PROPERTIES OF ORDERED INTERMETALLIC ALLOYS - 1ST-PRINCIPLES AND APPROXIMATE METHODS

      Materials science & engineering. A, Structural materials: properties, microstructure and processing


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Documento generato il 16/01/21 alle ore 16:59:56