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    1. Cortright, RD; Dumesic, JA
      Kinetics of heterogeneous catalytic reactions: Analysis of reaction schemes

      ADVANCES IN CATALYSIS, VOL 46
    2. Oliveri, F; Speciale, MP
      Exact solutions to the unsteady equations of perfect gases through Lie group analysis and substitution principles

      INTERNATIONAL JOURNAL OF NON-LINEAR MECHANICS
    3. Rochat, MC
      Considerations for successful fracture repair

      VETERINARY MEDICINE
    4. Feng, YQ; Wang, CY; Chen, NK
      Electronic structures of nickel metal with hydrogen impurity

      SCIENCE IN CHINA SERIES E-TECHNOLOGICAL SCIENCES
    5. Compagnini, A; Cunsolo, V; Foti, S; Saletti, R
      Improved accuracy in the matrix-assisted laser desorption/ionization-mass spectrometry determination of the molecular mass of cyanogen bromide fragments of proteins by post-cleavage reaction with tris(hydroxymethyl)aminomethane

      PROTEOMICS
    6. Namiesnik, J
      Green analytical chemistry - Some remarks

      JOURNAL OF SEPARATION SCIENCE
    7. Yin, XL; Han, HM; Miyamoto, A
      Structure and adsorption properties of MoO3: insights from periodic density functional calculations

      JOURNAL OF MOLECULAR MODELING
    8. Cygan, RT
      Molecular modeling in mineralogy and geochemistry

      MOLECULAR MODELING THEORY: APPLICATIONS IN THE GEOSCIENCES
    9. Rustad, JR
      Molecular models of surface relaxation, hydroxylation, and surface charging at oxide-water interfaces

      MOLECULAR MODELING THEORY: APPLICATIONS IN THE GEOSCIENCES
    10. Rosso, KM
      Structure and reactivity of semiconducting mineral surfaces: Convergence of molecular modeling and experiment

      MOLECULAR MODELING THEORY: APPLICATIONS IN THE GEOSCIENCES
    11. Nyanguile, O; Verdine, GL
      Template-directed interference footprinting of protein-phosphate contacts in DNA

      ORGANIC LETTERS
    12. Skolnick, J; Kolinski, A
      Computational studies of protein folding

      COMPUTING IN SCIENCE & ENGINEERING
    13. San Miguel, MA; Calzado, CJ; Sanz, JF
      Modeling alkali atoms deposition on TiO2 (110) surface

      JOURNAL OF PHYSICAL CHEMISTRY B
    14. Boronat, M; Zicovich-Wilson, CM; Viruela, P; Corma, A
      Influence of the local geometry of zeolite active sites and olefin size onthe stability of alkoxide intermediates

      JOURNAL OF PHYSICAL CHEMISTRY B
    15. Kato, T; Kang, SY; Xu, X; Yamabe, T
      Possible dissociative adsorption of CH3OH and CH3NH2 on Si(100)-2 x 1 surface

      JOURNAL OF PHYSICAL CHEMISTRY B
    16. Raugei, S; Klein, ML
      Ab initio molecular dynamics investigation of the formyl cation in the superacid SbF5/HF

      JOURNAL OF PHYSICAL CHEMISTRY B
    17. Lin, X; Ramer, NJ; Rappe, AM; Hass, KC; Schneider, WF; Trout, BL
      Effect of particle size on the adsorption of O and S atoms on Pt: A density-functional theory study

      JOURNAL OF PHYSICAL CHEMISTRY B
    18. Mihaleva, VV; van Santen, RA; Jansen, APJ
      A DFT study of methanol adsorption in 8T rings of chabazite

      JOURNAL OF PHYSICAL CHEMISTRY B
    19. Kandalam, AK; Blanco, MA; Pandey, R
      Theoretical study of structural and vibrational properties of Al3N3, Ga3N3, and In3N3

      JOURNAL OF PHYSICAL CHEMISTRY B
    20. Chen, ZX; Chen, Y; Jiang, YS
      DFT study on ferroelectricity of BaTiO3

      JOURNAL OF PHYSICAL CHEMISTRY B
    21. Kuo, IF; Tobias, DJ
      Electronic polarization and hydration of the dimethyl phosphate anion: An ab initio molecular dynamics study

      JOURNAL OF PHYSICAL CHEMISTRY B
    22. Lebedev, MV
      Sulfur adsorption at GaAs: Role of the adsorbate solvation and reactivity in modification of semiconductor surface electronic structure

      JOURNAL OF PHYSICAL CHEMISTRY B
    23. Hamaguchi, K; Machida, S; Nagao, M; Yasui, F; Mukai, K; Yamashita, Y; Yoshinobu, J; Kato, HS; Okuyama, H; Kawai, M; Sato, T; Iwatsuki, M
      Bonding and structure of 1,4-cyclohexadiene chemisorbed on Si(100)(2x1)

      JOURNAL OF PHYSICAL CHEMISTRY B
    24. Treesukol, P; Limtrakul, J; Truong, TN
      Adsorption of nitrogen monoxide and carbon monoxide on copper-exchanged ZSM-5: A cluster and embedded cluster study

      JOURNAL OF PHYSICAL CHEMISTRY B
    25. Mali, RS; Babu, KN; Jagtap, PG
      Expedient syntheses of naturally occurring (+/-)-3-benzylphthalides and (+/-)-3-aryl-8-hydroxy-3,4-dihydroisocoumarins: Structure revision of the (+/-)-3-benzylphthalide isolated from Frullania falciloba

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1
    26. Yeo, JSL; Vittal, JJ; Henderson, W; Hor, TSA
      Probing the Lewis basicity of the metalloligand [Pt-2(mu-Se)(2)(PPh3)(4)] on tin substrates by electrospray mass spectrometry

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    27. Compagnini, A; Cunsolo, V; Foti, S; Saletti, R
      Improved accuracy in the matrix-assisted laser desorption/ionisation mass spectrometry determination of the molecular mass of cyanogen bromide fragments of proteins by post-cleavage reaction with tris(hydroxymethyl)aminomethane

      EUROPEAN JOURNAL OF MASS SPECTROMETRY
    28. Morpurgo, S; Bossa, M; Morpurgo, GO
      A theoretical study of hydrogen bonding, proton transfer and kinetic isotope effects in the dimers of 2-tetrahydropyranol and in the 2-tetrahydropyranol-H2O adducts

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    29. Braithwaite, JS; Richard, C; Catlow, A; Harding, JH; Gale, JD
      A theoretical study of lithium intercalation into V6O13 - a combined classical, quantum mechanical approach

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    30. Alfredsson, M; Catlow, CRA
      Modelling of Pd and Pt supported on the {111} and {011} surfaces of cubic-ZrO2

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    31. Pagliai, M; Raugei, S; Cardini, G; Schettino, V
      Ab-initio molecular dynamics study of the S(N)2 reaction Cl-+ClCH2CN

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    32. Shaw, AM; Zare, RN; Bennett, CV; Kolner, BH
      Bounce-by-bounce cavity ring-down spectroscopy: Femtosecond temporal imaging

      CHEMPHYSCHEM
    33. Jarvis, EAA; Hayes, RL; Carter, EA
      Effects of oxidation on the nanoscale mechanisms of crack formation in aluminum

      CHEMPHYSCHEM
    34. Willaime, F
      Impact of electronic structure calculations on the study of diffusion in metals

      ADVANCED ENGINEERING MATERIALS
    35. Rdzanek, WJ; Rdzanek, WP; Engel, Z
      Asymptotic formulae for the acoustic power output of a simply-supported circular plate

      ACUSTICA
    36. Petersen, PH; Stockl, D; Westgard, JO; Sandberg, S; Linnet, K; Thienpont, L
      Models for combining random and systematic errors. Assumptions and consequences for different models

      CLINICAL CHEMISTRY AND LABORATORY MEDICINE
    37. Chaichian, M; Demichev, A; Presnajder, P; Tureanu, A
      Space-time noncommutativity, discreteness of time and unitarity

      EUROPEAN PHYSICAL JOURNAL C
    38. Doll, K
      Density functional study of the adsorption of K on the Cu(111) surface

      EUROPEAN PHYSICAL JOURNAL B
    39. Rappelsberger, P; Trenker, E; Rothmann, C; Gruber, G; Sykacek, P; Roberts, S; Klosch, G; Zeitlhofer, J; Anderer, P; Saletu, B; Schlogl, A; Varri, A; Kemp, B; Penzel, T; Herrmann, W; Hasan, J; Barbanoj, MJ; Kunz, D; Dorffner, G
      The SIESTA project

      KLINISCHE NEUROPHYSIOLOGIE
    40. Mello, JV; Finney, NS
      Dual-signaling fluorescent chemosensors based on conformational restriction and induced charge transfer

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    41. Berek, D
      Liquid chromatography of macromolecules at the point of exclusion-adsorption transition

      MATERIALS RESEARCH INNOVATIONS
    42. Perez, P; Toro-Labbe, A
      Theoretical analysis of some substituted imine-enamine tautomerism

      THEORETICAL CHEMISTRY ACCOUNTS
    43. Cargnoni, F; Gatti, C
      Direct-space analysis of the Si-Si bonding pattern in the pi-bonded chain reconstructed Si(111)(2 x 1) surface

      THEORETICAL CHEMISTRY ACCOUNTS
    44. Guyard, L; Audebert, P
      Synthesis and electrochemical polymerization of bis-dithienyl cyclophane

      ELECTROCHEMISTRY COMMUNICATIONS
    45. Tani, T; Ushida, T; Kimura, J
      Sequential changes of orthodromic sensory nerve action potentials induced by experimental compression of the median nerve at the wrist

      CLINICAL NEUROPHYSIOLOGY
    46. Zhang, DX; Tao, WA; Cooks, RG
      Chiral resolution of D- and L-amino acids by tandem mass spectrometry of Ni(II)-bound trimeric complexes

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    47. Payne, MC; Hytha, M; Stich, I; Gale, JD; Terakura, K
      First principles calculation of the free energy barrier for the reaction of methanol in a zeolite catalyst

      MICROPOROUS AND MESOPOROUS MATERIALS
    48. Benco, L; Demuth, T; Hafner, J; Hutschka, F
      Ab initio molecular dynamics simulation of hydration and ion-exchange processes in low Al-zeolites

      MICROPOROUS AND MESOPOROUS MATERIALS
    49. Katircioglu, S; Erkoc, S
      Structural and electronic properties of bare and hydrogenated silicon clusters

      PHYSICA E
    50. Severinsen, M
      Principles behind definitions of diseases - A criticism of the principle of disease mechanism and the development of a pragmatic alternative

      THEORETICAL MEDICINE AND BIOETHICS
    51. Druzovec, M; Welzer, T; Colnaric, M; Gyorkos, J
      Diagnostics and a qualitative model

      INTERNATIONAL JOURNAL OF MEDICAL INFORMATICS
    52. Alziary, B; Fleckinger-Pelle, J; Takac, P
      Positivity and negativity of solutions to a Schrodinger equation in R-N

      POSITIVITY
    53. Bock, JR; Gough, DA
      Predicting protein-protein interactions from primary structure

      BIOINFORMATICS
    54. Bassingthwaighte, JB
      The modelling of a primitive 'sustainable' conservative cell

      PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
    55. Talbot, DRS
      Improved bounds for the overall properties of a nonlinear composite dielectric

      PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
    56. Eberhart, M
      A quantum description of the chemical bond

      PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICSELECTRONIC OPTICAL AND MAGNETIC PROPERTIES
    57. Roundy, D; Krenn, CR; Cohen, ML; Morris, JW
      The ideal strength of tungsten

      PHILOSOPHICAL MAGAZINE A-PHYSICS OF CONDENSED MATTER STRUCTURE DEFECTS ANDMECHANICAL PROPERTIES
    58. Joos, B; Zhou, J
      The Peierls-Nabarro model and the mobility of the dislocation

      PHILOSOPHICAL MAGAZINE A-PHYSICS OF CONDENSED MATTER STRUCTURE DEFECTS ANDMECHANICAL PROPERTIES
    59. Schweinfest, R; Kostlmeier, S; Ernst, F; Elsasser, C; Wagner, T; Finnis, MW
      Atomistic and electronic structure of Al/MgAl2O4 and Ag/MgAl2O4 interfaces

      PHILOSOPHICAL MAGAZINE A-PHYSICS OF CONDENSED MATTER STRUCTURE DEFECTS ANDMECHANICAL PROPERTIES
    60. 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
    61. Foster, AS; Hofer, WA; Shluger, AL
      Quantitative modelling in scanning probe microscopy

      CURRENT OPINION IN SOLID STATE & MATERIALS SCIENCE
    62. Schneider, G; Shackelford, J
      Economics standards and lists: Proposed antidotes for feminist economists

      FEMINIST ECONOMICS
    63. Korhonen, J
      Industrial ecosystems - some conditions for success

      INTERNATIONAL JOURNAL OF SUSTAINABLE DEVELOPMENT AND WORLD ECOLOGY
    64. Yamaki, J; Egashira, M; Okada, S
      Thermodynamics and phase separation of lithium intercalation materials used in lithium ion cells

      ELECTROCHEMISTRY
    65. Munoz, P; Pastor, D; Capmany, J
      Analysis and design of arrayed waveguide gratings with MMI couplers

      OPTICS EXPRESS
    66. Axtell, C; Pepper, K; Clegg, C; Wall, T; Gardner, P
      Designing and evaluating now ways of working: The application of some sociotechnical tools

      HUMAN FACTORS AND ERGONOMICS IN MANUFACTURING
    67. Nadin, SJ; Waterson, PE; Parker, SK
      Participation in job redesign: An evaluation of the use of a sociotechnical tool and its impact

      HUMAN FACTORS AND ERGONOMICS IN MANUFACTURING
    68. Striefel, S
      Ethical research issues: Going beyond the declaration of Helsinki

      APPLIED PSYCHOPHYSIOLOGY AND BIOFEEDBACK
    69. Eddy, AL; Van Hoogmoed, LM; Snyder, JR
      The role of thermography in the management of equine lameness

      VETERINARY JOURNAL
    70. Sheu, SY; Schlag, EW; Yang, DY; Selzle, HL
      Efficiency of charge transport in a polypeptide chain: The isolated system

      JOURNAL OF PHYSICAL CHEMISTRY A
    71. Chattaraj, PK; Perez, P; Zevallos, J; Toro-Labbe, A
      Ab initio SCF and DFT studies on solvent effects on intramolecular rearrangement reactions

      JOURNAL OF PHYSICAL CHEMISTRY A
    72. Oison, V; Katan, C; Koenig, C
      Intramolecular electronic redistribution coupled to hydrogen bonding: An important mechanism for the "neutral-to-ionic" transition

      JOURNAL OF PHYSICAL CHEMISTRY A
    73. Sebastiani, D; Parrinello, M
      A new ab-initio approach for NMR chemical shifts in periodic systems

      JOURNAL OF PHYSICAL CHEMISTRY A
    74. Chattaraj, PK; Maiti, B
      Reactivity dynamics in atom-field interactions: A quantum fluid density functional study

      JOURNAL OF PHYSICAL CHEMISTRY A
    75. Goddard, WA; Cagin, T; Blanco, M; Vaidehi, N; Dasgupta, S; Floriano, W; Belmares, M; Kua, J; Zamanakos, G; Kashihara, S; Iotov, M; Gao, GH
      Strategies for multiscale modeling and simulation of organic materials: polymers and biopolymers

      COMPUTATIONAL AND THEORETICAL POLYMER SCIENCE
    76. Moan, J; Van den Akker, JTHM; Juzenas, P; Ma, LW; Angell-Petersen, E; Gadmar, OB; Iani, V
      On the basis for tumor selectivity in the 5-aminolevulinic acid-induced synthesis of protoporphyrin IX

      JOURNAL OF PORPHYRINS AND PHTHALOCYANINES
    77. Hurtado, JF; Melkote, SN
      Improved algorithm for tolerance-based stiffness optimization fixtures of machining

      JOURNAL OF MANUFACTURING SCIENCE AND ENGINEERING-TRANSACTIONS OF THE ASME
    78. Bauml, KH
      Increments and decrements in color constancy

      JOURNAL OF THE OPTICAL SOCIETY OF AMERICA A-OPTICS IMAGE SCIENCE AND VISION
    79. Miranda, D; Krueger, RR
      Highlights of the 1st international congress of wavefront sensing and aberration-free refractive correction

      JOURNAL OF REFRACTIVE SURGERY
    80. Lebedev, LP; Kalpakides, VK; Foutsitzi, G
      Solvability of boundary value problems of the dynamics of nonlinear viscoelastic shells

      MATHEMATICS AND MECHANICS OF SOLIDS
    81. Gomella, LG; El-Gabry, EA; Strup, SE; Halpern, E
      Ultrasound contrast agents for prostate imaging and biopsy

      UROLOGIC ONCOLOGY
    82. Guan, ZQ; Liesch, JM
      Salvation of acylium fragment ions in electrospray ionization quadrupole ion trap and Fourier transform ion cyclotron resonance mass spectrometry

      JOURNAL OF MASS SPECTROMETRY
    83. Quirke, JME; Van Berkel, GJ
      Electrospray tandem mass spectrometric study of ferrocene carbamate ester derivatives of saturated primary, secondary and tertiary alcohols

      JOURNAL OF MASS SPECTROMETRY
    84. Bure, C; Gobert, W; Lelievre, D; Delmas, A
      In-source fragmentation of peptide aldehydes and acetals: influence of peptide length and charge state

      JOURNAL OF MASS SPECTROMETRY
    85. Blanco-Molina, M; Tron, GC; Macho, A; Lucena, C; Calzado, MA; Munoz, E; Appendino, G
      Ingenol esters induce apoptosis in Jurkat cells through an AP-1 and NF-kappa B independent pathway

      CHEMISTRY & BIOLOGY
    86. Wang, Y; Tsai, HL
      Effects of surface active elements on weld pool fluid flow and weld penetration in gas metal arc welding

      METALLURGICAL AND MATERIALS TRANSACTIONS B-PROCESS METALLURGY AND MATERIALS PROCESSING SCIENCE
    87. Thimbleby, H
      Permissive user interfaces

      INTERNATIONAL JOURNAL OF HUMAN-COMPUTER STUDIES
    88. Tovbin, YK; Zhidkova, LK; Komarov, VN
      The fundamentals of adsorption theory for a mixture of bulky molecules in slit-shaped pores with heterogeneous wall surfaces

      RUSSIAN CHEMICAL BULLETIN
    89. Holmes, HB
      When health means wealth, can bioethicists respond?

      HEALTH CARE ANALYSIS
    90. Shein, IR; Medvedeva, NI; Ivanovskii, AL
      The band structures of superconducting MgB2 and the isostructural compounds CaGa2, AgB2, AuB2, ZrBe2, and HfBe2

      PHYSICS OF THE SOLID STATE
    91. Zinenko, VI; Zamkova, NG
      Lattice dynamics and statistical mechanics of the Fm3m -> I4/m structural phase transition in Rb2KInF6

      PHYSICS OF THE SOLID STATE
    92. Onopko, DE; Ryskin, AI
      Physical foundations of metastable impurity center reconstruction in semiconductors

      SEMICONDUCTORS
    93. Lebedev, MV
      Role of sulfide ion solvation in the modification of GaAs surface electronic structure

      SEMICONDUCTORS
    94. Antonov, VN; Uba, L; Uba, S; Yaresko, AN; Perlov, AY; Nemoshkalenko, VV
      Magnetooptical spectroscopy of magnetic multilayers: Theory and experiment(A review)

      LOW TEMPERATURE PHYSICS
    95. Fan, K; Wang, J; Wang, W
      Modeling two-state cooperativity in protein folding - art. no. 041907

      PHYSICAL REVIEW E
    96. Rambidi, NG; Yakovenchuk, D
      Chemical reaction-diffusion implementation of finding the shortest paths in a labyrinth - art. no. 026607

      PHYSICAL REVIEW E
    97. Yashin, YI; Yashin, AY
      Current trends in gas chromatography methods and instrumentation: A scientometric study

      JOURNAL OF ANALYTICAL CHEMISTRY
    98. Arencibia, A; Vazquez, JM; Ramirez, JA; Ramirez, G; Vilar, JM; Rivero, MA; Alayon, S; Gil, F
      Magnetic resonance imaging of the normal equine brain

      VETERINARY RADIOLOGY & ULTRASOUND
    99. Schentag, JJ; Gilliland, KK; Paladino, JA
      What have we learned from pharmacokinetic and pharmacodynamic theories?

      CLINICAL INFECTIOUS DISEASES
    100. Ochs, T; Kostlmeier, S; Elsasser, C
      Microscopic structure and bonding at the Pd/SrTiO3 (001) interface - An ab-initio local-density-functional study

      INTEGRATED FERROELECTRICS


ASDD Area Sistemi Dipartimentali e Documentali, Università di Bologna, Catalogo delle riviste ed altri periodici
Documento generato il 19/02/20 alle ore 15:06:23