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La ricerca find articoli where soggetti phrase all words 'TIGHT-BINDING' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 748 riferimenti
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    1. Kohler, C; Seifert, G; Gerstmann, U; Elstner, M; Overhof, H; Frauenheim, T
      Approximate density-functional calculations of spin densities in large molecular systems and complex solids

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    2. Valladares, AA; Alvarez, F; Liu, Z; Sticht, J; Harris, J
      Ab initio studies of the atomic and electronic structure of pure and hydrogenated a-Si

      EUROPEAN PHYSICAL JOURNAL B
    3. Duan, SQ; Zhang, W; Zhao, XG
      Rabi oscillations between dissipative Bloch bands

      PHYSICA E
    4. Tessieri, L; Izrailev, FM
      One-dimensional tight-binding models with correlated diagonal and off-diagonal disorder

      PHYSICA E
    5. Bryant, GW; Jaskolski, W
      Designing quantum dots and quantum-dot solids

      PHYSICA E
    6. Ganter, C; Schirmacher, W
      Generalizated effective-medium approximation for hopping transport in topologically disordered systems

      PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICSELECTRONIC OPTICAL AND MAGNETIC PROPERTIES
    7. Arya, A; Banerjee, S; Das, GP; Dasgupta, I; Saha-Dasgupta, T; Mookerjee, A
      A first-principles thermodynamic approach to ordering in Ni-Mo alloys

      ACTA MATERIALIA
    8. Lombardo, F; Gandini, L; Dondero, F; Lenzi, A
      Immunology and immunopathology of the male genital tract - Antisperm immunity in natural and assisted reproduction

      HUMAN REPRODUCTION UPDATE
    9. Masuda-Jindo, K
      Tight-binding theory in the computational materials science

      MATERIALS TRANSACTIONS
    10. Gottschall, RJ
      Recent advances and future research directions in bulk metallic glasses

      MATERIALS TRANSACTIONS
    11. Amkreutz, M; Jungnickel, G; Seifert, G; Kohler, T; Frauenheim, T
      On the structural and electronic properties of fluorinated carbon allotropes

      NEW DIAMOND AND FRONTIER CARBON TECHNOLOGY
    12. Dedryvere, R; Lippens, PE; Jumas, JC; Lefebvre-Devos, I; Vicente, CP
      Influence of the sulfur vacancies on the electronic properties of In16Sn4S32

      SOLID STATE SCIENCES
    13. Reale, A; Di Carlo, A; Lugli, P
      Gain dynamics in traveling-wave semiconductor optical amplifiers

      IEEE JOURNAL OF SELECTED TOPICS IN QUANTUM ELECTRONICS
    14. Asta, M; Ozolins, V; Woodward, C
      A first-principles approach to modeling alloy phase equilibria

      JOM-JOURNAL OF THE MINERALS METALS & MATERIALS SOCIETY
    15. Bonifacio, MJ; Vieira-Coelho, MA; Soares-da-Silva, P
      Expression and characterization of rat soluble catechol-O-methyltransferase fusion protein

      PROTEIN EXPRESSION AND PURIFICATION
    16. Klink, TA; Vicentini, AM; Hofsteenge, J; Raines, RT
      High-level soluble production and characterization of porcine ribonucleaseinhibitor

      PROTEIN EXPRESSION AND PURIFICATION
    17. Damanik, D; Stollmann, P
      Multi-scale analysis implies strong dynamical localization

      GEOMETRIC AND FUNCTIONAL ANALYSIS
    18. Deng, WJ
      Probability currents and conservation of probability in Hilbert space

      ACTA PHYSICA SINICA
    19. Pan, BC
      Tight-binding potential with correction of bonding environment for silicon-hydrogen

      ACTA PHYSICA SINICA
    20. Ding, CG; Yang, JL; Li, QX
      Geometrical and electronic structures of vanadium clusters, and their evolution from molecular to bulk phase

      ACTA PHYSICA SINICA
    21. Seno, K; Okuno, T; Nishi, K; Murakami, Y; Yamada, K; Nakamoto, S; Ono, T
      Pyrrolidine inhibitors of human cytosolic phospholipase A(2). part 2: Synthesis of potent and crystallized 4-triphenylmethylthio derivative 'pyrrophenone'

      BIOORGANIC & MEDICINAL CHEMISTRY LETTERS
    22. Perez-Alvarez, R; Garcia-Moliner, F; Velasco, VR
      Some elementary questions in the theory of quasiperiodic heterostructures

      JOURNAL OF PHYSICS-CONDENSED MATTER
    23. Bozza, PT; Weller, PF
      Arachidonyl trifluoromethyl ketone induces lipid body formation in leukocytes

      PROSTAGLANDINS LEUKOTRIENES AND ESSENTIAL FATTY ACIDS
    24. Cleri, F
      Atomic and electronic structure of high-energy grain boundaries in siliconand carbon

      COMPUTATIONAL MATERIALS SCIENCE
    25. Hu, HF; Li, YB; He, HB
      Electronic properties of carbon nanotubes with pentagon-heptagon pair defects

      DIAMOND AND RELATED MATERIALS
    26. Albe, V; Lewis, LJ
      Optical properties of InAs/InP ultrathin quantum wells

      PHYSICA B
    27. Bacalis, NC; Papaconstantopoulos, DA; Mehl, MJ; Lach-Hab, M
      Transferable tight-binding parameters for ferromagnetic and paramagnetic iron

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

      PHYSICA B
    29. Klimeck, G; Bowen, RC; Boykin, TB
      Strong wavevector dependence of hole transport in heterostructures

      SUPERLATTICES AND MICROSTRUCTURES
    30. Ekpunobi, AJ; Animalu, AOE
      Band offsets and properties of Si1-xGex/Si material systems

      SUPERLATTICES AND MICROSTRUCTURES
    31. Hjort, M; Stafstrom, S
      Localization in defected chiral carbon nanotubes

      SYNTHETIC METALS
    32. Yamabe, T; Imade, M; Tanaka, M; Sato, T
      Electronic structures and transport properties of carbon nanotube

      SYNTHETIC METALS
    33. Lima, RPA; Lyra, ML
      Quantum percolation in power-law diluted chains

      PHYSICA A
    34. Lu, ZG; Luo, CL
      Tight binding method simulation of the formation of nanotube

      PHYSICS LETTERS A
    35. Kim, E; Chen, CF
      Stability of tetragonal crystalline carbon nitrides: the nitrogen content dependence

      PHYSICS LETTERS A
    36. Andrzejewski, J; Misiewicz, J
      Energy band structure of Zn3P2-type semiconductors: Analysis of the crystal structure simplifications and energy band calculations

      PHYSICA STATUS SOLIDI B-BASIC RESEARCH
    37. Sun, HQ; Ren, Y; Wang, GH
      Structural, electronic, and magnetic properties of mixed V13-xRhx (x=0 to 13) clusters

      PHYSICA STATUS SOLIDI B-BASIC RESEARCH
    38. de Prunele, E; Bouju, X
      Fibonacci, Koch, and Penrose structures: Spectrum of finite subsystems in three-dimensional space

      PHYSICA STATUS SOLIDI B-BASIC RESEARCH
    39. Losev, A; Vlaev, S
      Modelling electronic spectra of crystals in electric fields with various orientations

      PHYSICA STATUS SOLIDI B-BASIC RESEARCH
    40. Cao, W; Chen, Q; Sohn, UD; Kim, N; Kirber, MT; Harnett, KM; Behar, J; Biancani, P
      Ca2+-induced contraction of cat esophageal circular smooth muscle cells

      AMERICAN JOURNAL OF PHYSIOLOGY-CELL PHYSIOLOGY
    41. Solovyev, IV; Terakura, K
      Double-exchange model for bilayered manganites

      JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS
    42. Suh, SH; Min, WK; Kim, WC; Rho, SB; Ahn, WS; Ha, KR; Lepadatu, C; Chihaia, V
      The energetic and electronic properties of atomic hydrogen on MgO(001) surface: Tight-binding and ab initio calculations

      KOREAN JOURNAL OF CHEMICAL ENGINEERING
    43. Wang, WG
      Statistics of eigenfunctions in 1D tight binding model: Distribution of Riccati variable

      COMMUNICATIONS IN THEORETICAL PHYSICS
    44. Meunier, I; Tetot, R; Treglia, G; Legrand, B
      Thermal dependence of surface polymorphism: the Ag/Cu (111) case

      APPLIED SURFACE SCIENCE
    45. Tagami, K; Sasaki, N; Tsukada, M
      Simulated nc-AFM images of Si(001) surface with nanotube tip

      APPLIED SURFACE SCIENCE
    46. Clemens, F; Drutkowski, G; Wiese, M; Frohberg, P
      The inactivation of lipoxygenase-1 from soybeans by amidrazones

      BIOCHIMICA ET BIOPHYSICA ACTA-PROTEIN STRUCTURE AND MOLECULAR ENZYMOLOGY
    47. Mendizabal, F; Olea-Azar, C; Zapata-Torres, G; Eisner, F
      Metallomacrocycle complex bridged polymers: electronic structures of -[MacM(L)](n)

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    48. Ozaki, T
      Efficient recursion method for inverting an overlap matrix - art. no. 195110

      PHYSICAL REVIEW B
    49. Julien, JP; Turchi, PEA; Mayou, D
      Real-space solution of the coherent potential approximation equations in the Shiba approximation - art. no. 195119

      PHYSICAL REVIEW B
    50. Meunier, V; Nardelli, MB; Roland, C; Bernholc, J
      Structural and electronic properties of carbon nanotube tapers - art. no. 195419

      PHYSICAL REVIEW B
    51. Yu, M; Jayanthi, CS; Drabold, DA; Wu, SY
      Strain relaxation mechanisms and local structural changes in Si1-xGex alloys - art. no. 165205

      PHYSICAL REVIEW B
    52. Lehmann, G; Hess, P; Wu, JJ; Wu, CT; Wong, TS; Chen, KH; Chen, LC; Lee, HY; Amkreutz, M; Frauenheim, T
      Structure and elastic properties of amorphous silicon carbon nitride films- art. no. 165305

      PHYSICAL REVIEW B
    53. Vidal, J; Butaud, P; Doucot, B; Mosseri, R
      Disorder and interactions in Aharonov-Bohm cages - art. no. 155306

      PHYSICAL REVIEW B
    54. Hadjisavvas, G; Kopidakis, G; Kelires, PC
      Structural models of amorphous silicon surfaces - art. no. 125413

      PHYSICAL REVIEW B
    55. Perez-Conde, J; Bhattacharjee, AK; Chamarro, M; Lavallard, P; Petrikov, VD; Lipovskii, AA
      Photoluminescence Stokes shift and exciton fine structure in CdTe nanocrystals - art. no. 113303

      PHYSICAL REVIEW B
    56. Kim, DH; Sim, HS; Chang, KJ
      Electronic and transport properties of single-wall carbon nanotubes encapsulating fullerene-based structures - art. no. 115409

      PHYSICAL REVIEW B
    57. Kim, E; Chen, CF; Kohler, T; Elstner, M; Frauenheim, T
      Theoretical study of a body-centered-tetragonal phase of carbon nitride - art. no. 094107

      PHYSICAL REVIEW B
    58. Kohler, C; Hajnal, Z; Deak, P; Frauenheim, T; Suhai, S
      Theoretical investigation of carbon defects and diffusion in alpha-quartz - art. no. 085333

      PHYSICAL REVIEW B
    59. Alippi, P; Colombo, L; Ruggerone, P; Sieck, A; Seifert, G; Frauenheim, T
      Atomic-scale characterization of boron diffusion in silicon - art. no. 075207

      PHYSICAL REVIEW B
    60. Chirico, F; Di Carlo, A; Lugli, P
      Efficient self-consistent pseudopotential calculation of nanostructured devices - art. no. 045314

      PHYSICAL REVIEW B
    61. Perez-Conde, J; Bhattacharjee, AK
      Exciton states and optical properties of CdSe nanocrystals - art. no. 245318

      PHYSICAL REVIEW B
    62. Krasheninnikov, AV; Nordlund, K; Sirvio, M; Salonen, E; Keinonen, J
      Formation of ion-irradiation-induced atomic-scale defects on walls of carbon nanotubes - art. no. 245405

      PHYSICAL REVIEW B
    63. Nakhmanson, SM; Voyles, PM; Mousseau, N; Barkema, GT; Drabold, DA
      Realistic models of paracrystalline silicon - art. no. 235207

      PHYSICAL REVIEW B
    64. Shevlin, SA; Fisher, AJ; Hernandez, E
      Series of (nX2) Si-rich reconstructions of beta-SiC(001): A prospective atomic wire - art. no. 195306

      PHYSICAL REVIEW B
    65. Klimeck, G; Bowen, RC; Boykin, TB
      Off-zone-center or indirect band-gap-like hole transport in heterostructures - art. no. 195310

      PHYSICAL REVIEW B
    66. Guirado-Lopez, R
      Magnetic anisotropy of fcc transition-metal clusters: Role of surface relaxation - art. no. 177420

      PHYSICAL REVIEW B
    67. Sternberg, M; Kaukonen, M; Nieminen, RM; Frauenheim, T
      Growth of (110) diamond using pure dicarbon - art. no. 165414

      PHYSICAL REVIEW B
    68. Bevilacqua, G; Martinelli, L; Parravicini, GP
      Effect of a magnetic field on an E circle times epsilon Jahn-Teller system: Berry phase and optical properties - art. no. 132403

      PHYSICAL REVIEW B
    69. Hjort, M; Stafstrom, S
      Disorder-induced electron localization in metallic carbon nanotubes art. no. 113406

      PHYSICAL REVIEW B
    70. Fabris, S; Paxton, AT; Finnis, MW
      Free energy and molecular dynamics calculations for the cubic-tetragonal phase transition in zirconia - art. no. 094101

      PHYSICAL REVIEW B
    71. Bowler, DR; Fisher, AJ
      Small polaron formation in dangling-bond wires on the Si(001) surface - art. no. 035310

      PHYSICAL REVIEW B
    72. Germinet, F; Jitomirskaya, S
      Strong dynamical localization for the almost Mathieu model

      REVIEWS IN MATHEMATICAL PHYSICS
    73. Allen, RE; Dumitrica, T; Torralva, B
      Electronic and structural response of materials to fast, intense laser pulses

      ULTRAFAST PHYSICAL PROCESSES IN SEMICONDUCTORS
    74. Ando, I; Kuroki, S; Kurosu, H; Yamanobe, T
      NMR chemical shift calculations and structural characterizations of polymers

      PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY
    75. Shapiro, R
      Cytoplasmic ribonuclease inhibitor

      RIBONUCLEASES, PT A
    76. Korosak, D; Cvikl, B
      The microscopic model of Fermi level pinning in ionized cluster beam deposited Ag/n-Si Schottky structures

      VACUUM
    77. Pick, S; Dreysse, H
      Calculation of gas adsorption effect on magnetism of Co(0001)

      SURFACE SCIENCE
    78. Krasheninnikov, AV
      Predicted scanning tunneling microscopy images of carbon nanotubes with atomic vacancies

      SOLID STATE COMMUNICATIONS
    79. Bockrath, M; Liang, WJ; Bozovic, D; Hafner, JH; Lieber, CM; Tinkham, M; Park, HK
      Resonant electron scattering by defects in single-walled carbon nanotubes

      SCIENCE
    80. Ouyang, M; Huang, JL; Cheung, CL; Lieber, CM
      Atomically resolved single-walled carbon nanotube intramolecular junctions

      SCIENCE
    81. Gaggero-Sager, LM; M'Peko, JC; Perez-Alvarez, R
      Thomas-Fermi approximation in two p-type delta-doped quantum wells in GaAsand Si

      REVISTA MEXICANA DE FISICA
    82. Olguin, D; Baquero, R; de Coss, R
      The band gap of II-VI ternary alloys in a tight-binding description

      REVISTA MEXICANA DE FISICA
    83. Ito, T; Nishidate, K; Baba, M; Hasegawa, M
      Pressure-controlled tight-binding molecular dynamics simulation of carbon nanotubes

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    84. Koga, J; Nishio, K; Yamaguchi, T; Yonezawa, F
      Tight-binding electronic state calculations of silicon nanostructures withlocal disorders: Origin of the 'F' band luminescence from porous silicon

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    85. Iguchi, K
      Semiconductivity and band gap of a double strand of DNA

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    86. Shyu, FL; Lin, MF; Chang, CP; Chen, RB; Shyu, JS; Wang, YC; Liao, CH
      Tight-binding band structures of nanographite multiribbons

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    87. Koga, J; Nishio, K; Yamaguchi, T; Yonezawa, F
      The effects of the point-group symmetry in silicon nanostructures on radiative recombination time

      JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN
    88. Hirsch, JE
      Dynamic Hubbard model - art. no. 206402

      PHYSICAL REVIEW LETTERS
    89. Stojkovic, D; Zhang, PH; Crespi, VH
      Smallest nanotube: Breaking the symmetry of sp(3) bonds in tubular geometries - art. no. 125502

      PHYSICAL REVIEW LETTERS
    90. Tanaka, M; Higo, Y
      Large tunneling magnetoresistance in GaMnAs/AlAs/GaMnAs ferromagnetic semiconductor tunnel junctions - art. no. 026602

      PHYSICAL REVIEW LETTERS
    91. Charlier, JC; Rignanese, GM
      Electronic structure of carbon nanocones

      PHYSICAL REVIEW LETTERS
    92. Nonas, B; Cabria, I; Zeller, R; Dederichs, PH; Huhne, T; Ebert, H
      Strongly enhanced orbital moments and anisotropies of adatoms on the Ag(001) surface

      PHYSICAL REVIEW LETTERS
    93. Adhikari, S; Baer, R
      Augmented Lagrangian method for order-N electronic structure

      JOURNAL OF CHEMICAL PHYSICS
    94. Elstner, M; Hobza, P; Frauenheim, T; Suhai, S; Kaxiras, E
      Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment

      JOURNAL OF CHEMICAL PHYSICS
    95. Mollard, C; Moali, C; Papamicael, C; Damblon, C; Vessilier, S; Amicosante, G; Schofield, CJ; Galleni, M; Frere, JM; Roberts, GCK
      Thiomandelic acid, a broad spectrum inhibitor of zinc beta-lactamases - Kinetic and spectroscopic studies

      JOURNAL OF BIOLOGICAL CHEMISTRY
    96. Reis, M; Farage, M; de Souza, ACL; de Meis, L
      Correlation between uncoupled ATP hydrolysis and heat production by the sarcoplasmic reticulum Ca2+-ATPase - Coupling effect of fluoride

      JOURNAL OF BIOLOGICAL CHEMISTRY
    97. Dufour, EK; Denault, JB; Bissonnette, L; Hopkins, PCR; Lavigne, P; Leduc, R
      The contribution of arginine residues within the P6-P1 region of alpha(1)-antitrypsin to its reaction with furin

      JOURNAL OF BIOLOGICAL CHEMISTRY
    98. Spencer, J; Clarke, AR; Walsh, TR
      Novel mechanism of hydrolysis of therapeutic beta-lactams by Stenotrophomonas maltophilia L1 metallo-beta-lactamase

      JOURNAL OF BIOLOGICAL CHEMISTRY
    99. Rudolph, MG; Linnemann, T; Grunewald, P; Wittinghofer, A; Vetter, IR; Herrmann, C
      Thermodynamics of Ras/effector and Cdc42/effector interactions probed by isothermal titration calorimetry

      JOURNAL OF BIOLOGICAL CHEMISTRY
    100. Voyles, PM; Zotov, N; Nakhmanson, SM; Drabold, DA; Gibson, JM; Treacy, MMJ; Keblinski, P
      Structure and physical properties of paracrystalline atomistic models of amorphous silicon

      JOURNAL OF APPLIED PHYSICS


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Documento generato il 28/05/20 alle ore 21:45:07