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La ricerca find articoli where soggetti phrase all words '(H2O)(N)' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 198 riferimenti
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    1. Schulz, B; Triboulet, C; Audren, C; Pfeifer, HR; Gilg, A
      Two-stage prograde and retrograde Variscan metamorphism of glaucophane-eclogites, blueschists and greenschists from Ile de Groix (Brittany, France)

      INTERNATIONAL JOURNAL OF EARTH SCIENCES
    2. Erkoc, S; Kokten, H; Guvenc, Z
      Fragmentation of water clusters: Molecular-dynamics simulation study

      EUROPEAN PHYSICAL JOURNAL D
    3. Warneke, C; van der Veen, C; Luxembourg, S; de Gouw, JA; Kok, A
      Measurements of benzene and toluene in ambient air using proton-transfer-reaction mass spectrometry: calibration, humidity dependence, and field intercomparison

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    4. Wroblewski, T; Gazda, E; Mechlinska-Drewko, J; Karwasz, GP
      Swarm experiment on ionized water clusters

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    5. Fox, BS; Beyer, MK; Bondybey, VE
      Black body fragmentation of cationic ammonia clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    6. Laria, D; Rodriguez, J; Dellago, C; Chandler, D
      Dynamical aspects of isomerization and melting transitions in [H2O](8)

      JOURNAL OF PHYSICAL CHEMISTRY A
    7. Shevkunov, SV
      Scattering of centimeter radiowaves in a gas ionized by radioactive radiation: Cluster plasma formation

      JOURNAL OF EXPERIMENTAL AND THEORETICAL PHYSICS
    8. Shevkunov, SV
      Melting of water molecule clusters in a strong electric field under the conditions modeling Arctic stratosphere

      COLLOID JOURNAL
    9. Shevkunov, SV
      Cluster mechanism of the energy accumulation in a ball electric discharge

      DOKLADY PHYSICS
    10. Masamura, M
      Ab initio molecular orbital study of OH- (H2O)(n) in the gas phase

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    11. Famulari, A; Moroni, F; Raimondi, M; Thorsteinsson, T
      The structure of lithium and potassium cations coordinated by ammonia molecules in the gas phase as revealed by ab initio SCF-MI calculations

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    12. Muta, H; Kojima, R; Kawauchi, S; Tachibana, A; Satoh, M
      Ion-specificity for hydrogen-bonding hydration of polymer: an approach by ab initio molecular orbital calculations

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    13. Zvereva, NA
      Theoretical description of the photodissociation spectrum of monomer and dimer forms of water

      OPTICS AND SPECTROSCOPY
    14. Laenen, R; Roth, T
      Generation of solvated electrons in neat water: new results from femtosecond spectroscopy

      JOURNAL OF MOLECULAR STRUCTURE
    15. Roszak, S; Kowal, M; Gora, RW; Leszczynski, J
      The influence of the detachment of electrons on the properties and the nature of interactions in X-H2O (X=Cl, Br) complexes

      JOURNAL OF CHEMICAL PHYSICS
    16. Kowal, M; Gora, RW; Roszak, S; Leszczynski, J
      I-H2O and its neutral precursors: Similarities and differences

      JOURNAL OF CHEMICAL PHYSICS
    17. Wu, X; Vargas, MC; Nayak, S; Lotrich, V; Scoles, G
      Towards extending the applicability of density functional theory to weaklybound systems

      JOURNAL OF CHEMICAL PHYSICS
    18. Arunan, E; Emilsson, T; Gutowsky, HS; Dykstra, CE
      Rotational spectra and structures of the Ar-3-H2O and Ar-3-H2S symmetric tops

      JOURNAL OF CHEMICAL PHYSICS
    19. Lee, HM; Suh, SB; Kim, KS
      Structures, energies, and vibrational spectra of water undecamer and dodecamer: An ab initio study

      JOURNAL OF CHEMICAL PHYSICS
    20. Wright, NJ; Gerber, RB
      Extending the vibrational self-consistent method: Using a partially separable wave function for calculating anharmonic vibrational states of polyatomic molecules

      JOURNAL OF CHEMICAL PHYSICS
    21. Clements, TG; Luong, AK; Deyerl, HJ; Continetti, RE
      Dissociative photodetachment studies of O-(H2O)(2), OH-(H2O)(2), and the deuterated isotopomers: Energetics and three-body dissociation dynamics

      JOURNAL OF CHEMICAL PHYSICS
    22. Lee, JI; Sperry, DC; Farrar, JM
      Spectroscopy and reactivity of size-selected Mg+-methanol clusters

      JOURNAL OF CHEMICAL PHYSICS
    23. Lee, HM; Kim, KS
      Structures and spectra of iodide-water clusters I-(H2O)(n=1-6): An ab initio study

      JOURNAL OF CHEMICAL PHYSICS
    24. Mantz, YA; Geiger, FM; Molina, LT; Molina, MJ; Trout, BL
      The interaction of HCl with the (0001) face of hexagonal ice studied theoretically via Car-Parrinello molecular dynamics

      CHEMICAL PHYSICS LETTERS
    25. Lundell, J; Panek, J; Latajka, Z
      Quantum chemical calculations on FXeSiF

      CHEMICAL PHYSICS LETTERS
    26. Solca, N; Dopfer, O
      IR spectrum of the benzene-water cation: direct evidence for a hydrogen-bonded charge-dipole complex

      CHEMICAL PHYSICS LETTERS
    27. Angel, L; Stace, A
      Dissociation patterns of (H2O)(n)(+) cluster ions, for n=2-6

      CHEMICAL PHYSICS LETTERS
    28. Tzeli, D; Mavridis, A; Xantheas, SS
      A molecular level study of the aqueous microsolvation of acetylene

      CHEMICAL PHYSICS LETTERS
    29. Bolton, K; Pettersson, JBC
      Ice-catalyzed ionization of hydrochloric acid

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    30. Ludwig, R
      Hexamers: From covalently bound organic structures to hydrogen bonded water clusters

      CHEMPHYSCHEM
    31. Ugalde, JM; Alkorta, I; Elguero, J
      Water clusters: Towards an understanding based on first principles of their static and dynamic properties

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    32. Gadre, SR; Babu, K; Rendell, AP
      Electrostatics for exploring hydration patterns of molecules. 3. Uracil

      JOURNAL OF PHYSICAL CHEMISTRY A
    33. Mitsui, M; Ohshima, Y; Ishiuchi, S; Sakai, M; Fujii, M
      Structure and dynamics of 9(10H)-acridone and its hydrated clusters. II. Structural characterization of hydrogen-bonding networks

      JOURNAL OF PHYSICAL CHEMISTRY A
    34. Fedorov, AV; Cable, JR
      Spectroscopy of hydrogen-bonded formanilide clusters in a supersonic jet: Solvation of a model trans amide

      JOURNAL OF PHYSICAL CHEMISTRY A
    35. Hammam, E; Lee, EPF; Dyke, JM
      Ab initio molecular orbital calculations on NO+ center dot (H20)(n) cluster ions. Part I: Minimum-energy structures and possible routes to nitrous acid formation

      JOURNAL OF PHYSICAL CHEMISTRY A
    36. Devlin, JP; Joyce, C; Buch, V
      Infrared spectra and structures of large water clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    37. Masamura, M
      Error of atomic charges derived from electrostatic potential

      STRUCTURAL CHEMISTRY
    38. Hartke, B
      Global geometry optimization of molecular clusters: TIP4P water

      ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS
    39. Lee, GH; Bowen, KH
      Photoelectron spectrum of (D2O)(6)(-) cluster anions

      JOURNAL OF THE KOREAN PHYSICAL SOCIETY
    40. Vegiri, A; Farantos, SC
      Cluster collisions of water tetramers: a classical dynamical study

      CHEMICAL PHYSICS
    41. Peslherbe, GH; Ladanyi, BM; Hynes, JT
      Structure of NaI ion pairs in water clusters

      CHEMICAL PHYSICS
    42. Zhang, Y; Wang, YB; Sun, ZM; Tian, AM
      High level ab initio MO study an the H2O interacting with N-2

      CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
    43. Scholz, G; Krossner, M; Dummer, A; Stosser, R
      Structures, stabilities and vibrational frequencies of (AlF3)(m)center dotcenter dot center dot(H2O)(n) adducts. A density functional study

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    44. Masamura, M
      Ab initio MO study on the structures of OH- (H2O)(n) in the gas phase

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    45. Nauta, K; Miller, RE
      Formation of cyclic water hexamer in liquid helium: The smallest piece of ice

      SCIENCE
    46. Laenen, R; Roth, T; Laubereau, A
      Novel precursors of solvated electrons in water: Evidence for a charge transfer process

      PHYSICAL REVIEW LETTERS
    47. Amon, LM; Reinhardt, WP
      Development of reference states for use in absolute free energy calculations of atomic clusters with application to 55-atom Lennard-Jones clusters inthe solid and liquid states

      JOURNAL OF CHEMICAL PHYSICS
    48. Gruenloh, CJ; Carney, JR; Hagemeister, FC; Zwier, TS; Wood, JT; Jordan, KD
      Resonant ion-dip infrared spectroscopy of benzene-(water)(9): Expanding the cube

      JOURNAL OF CHEMICAL PHYSICS
    49. Portmann, S; Inauen, A; Luthi, HP; Leutwyler, S
      Chiral discrimination in hydrogen-bonded complexes

      JOURNAL OF CHEMICAL PHYSICS
    50. Day, PN; Pachter, R; Gordon, MS; Merrill, GN
      A study of water clusters using the effective fragment potential and MonteCarlo simulated annealing

      JOURNAL OF CHEMICAL PHYSICS
    51. Lee, HM; Suh, SB; Lee, JY; Tarakeshwar, P; Kim, KS
      Structures, energies, vibrational spectra, and electronic properties of water monomer to decamer

      JOURNAL OF CHEMICAL PHYSICS
    52. Chaudhuri, C; Jiang, JC; Wang, X; Lee, YT; Chang, HC
      Identification of CH3OH2+ and H3O+-centered cluster isomers from fragment-dependent vibrational predissociation spectra of H+(CH3OH)(4)H2O

      JOURNAL OF CHEMICAL PHYSICS
    53. Barran, PE; Walker, NR; Stace, AJ
      Competitive charge transfer reactions in small [Mg(H2O)(N)](2+) clusters

      JOURNAL OF CHEMICAL PHYSICS
    54. Soep, B; Elhanine, M; Schulz, CP
      Intracluster reactions of singly ionised magnesium atoms with dimethyl ether

      CHEMICAL PHYSICS LETTERS
    55. Qian, JA; Stockelmann, E; Hentschke, R
      Global potential energy minima of SPC/E water clusters without and with induced polarization using a genetic algorithm

      JOURNAL OF MOLECULAR MODELING
    56. Cabarcos, OM; Lisy, JM
      Molecular dynamics simulation of gas phase ion cluster formation

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    57. Beyer, M; Achatz, U; Berg, C; Joos, S; Niedner-Schatteburg, G; Bondybey, VE
      Size dependence of blackbody radiation induced hydrogen formation in Al+(H2O)(n) hydrated aluminum cations and their reactivity with hydrogen chloride

      JOURNAL OF PHYSICAL CHEMISTRY A
    58. Ayotte, P; Nielsen, SB; Weddle, GH; Johnson, MA; Xantheas, SS
      Spectroscopic observation of ion-induced water dimer dissociation in the X-center dot(H2O)(2) (X = F, Cl, Br, I) clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    59. Gruenloh, CJ; Hagemeister, FC; Carney, JR; Zwier, TS
      Resonant ion-dip infrared spectroscopy of ternary benzene-(water)(n)(methanol)(m) hydrogen-bonded clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    60. Schroder, D; Schwarz, H
      Generation, stability, and reactivity of small, multiply charged ions in the gas phase

      JOURNAL OF PHYSICAL CHEMISTRY A
    61. Milburn, RK; Baranov, V; Hopkinson, AC; Bohme, DK
      Gas-phase coordination of Mg+, (c-C5H5)Mg+, and (c-C5H5)(2)Mg+ with small inorganic ligands

      JOURNAL OF PHYSICAL CHEMISTRY A
    62. Takasu, R; Hashimoto, K; Okuda, R; Fuke, K
      Solvation of sodium dimer in ammonia clusters: Photoelectron spectroscopy and ab initio study of Na-2(-)(NH3)(n)

      JOURNAL OF PHYSICAL CHEMISTRY A
    63. Soldan, P; Lee, EPF; Jones, LA; Wright, TG
      Thermodynamics of NO+center dot N-2: Atmospheric relevance

      JOURNAL OF PHYSICAL CHEMISTRY A
    64. Bryce, RA; Vincent, MA; Hillier, IH
      Binding energy of F(H2O)(-) and the simulation of fluoride water clusters using a hybrid QM MM (fluctuating charge) potential

      JOURNAL OF PHYSICAL CHEMISTRY A
    65. Kim, J; Lee, JY; Oh, KS; Park, JM; Lee, S; Kim, KS
      Quantum-mechanical probabilistic structure of the water dimer with an excess electron

      PHYSICAL REVIEW A
    66. Hannan, JP; Whittaker, SBM; Davy, SL; Kuhlmann, UC; Pommer, AJ; Hemmings, AM; James, R; Kleanthous, C; Moore, GR
      NMR study of Ni2+ binding to the H-N-H endonuclease domain of colicin E9

      PROTEIN SCIENCE
    67. Wijaya, K; Moers, O; Blaschette, A; Jones, PG
      Polysulfonylamines, CXIX - Hydrogen bonding in crystalline onium dimesylamides: An antidromic eight-membered ring pattern as a robust supramolecular synthon - Three prototypical structures

      ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES
    68. Adachi, M; Kim, CS; Kim, TO; Okuyama, K
      Effects of NO2 gas on gas-to-particle conversion of SO2 by alpha-ray radiolysis

      KAGAKU KOGAKU RONBUNSHU
    69. Chylek, P; Fu, Q; Tso, HCW; Geldart, DJW
      Contribution of water vapor dimers to clear sky absorption of solar radiation

      TELLUS SERIES A-DYNAMIC METEOROLOGY AND OCEANOGRAPHY
    70. Lee, HM; Son, HS; Mhin, BJ
      The importance of thermodynamic quantities for the determination of the unknown conformation: Ab initio studies of K+(H2O)(3)

      BULLETIN OF THE KOREAN CHEMICAL SOCIETY
    71. Aida, M; Yamataka, H
      An ab initio MO study on the hydrolysis of methyl chloride

      THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE
    72. Asada, T; Kato, N; Kitaura, K
      Structures of Cl-CH3Cl(H2O)(n) (n = 0, 1, 2) cluster at room temperature from Monte Carlo samplings using the ab initio MO method

      THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE
    73. Otero, L; Benitez, J; Gambino, D; Kremer, E; Baran, EJ; Mombru, A; Suescun, L; Mariezcurrena, R
      [Re-III(thiourea-S)(6)]Cl-3 center dot 4H(2)O and [Re-III(N-methylthiourea-S)(6)]Cl-3 as precursors to other Re-III complexes: a kinetic study in aqueous media. Crystal structure of [Re-III(N-methylthiourea-S)(6)](PF6)(3)center dot H2O

      ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE
    74. Gebhardt, CR; Schroder, H; Kompa, KL
      Surface impact ionization of polar-molecule clusters through pickup of alkali atoms

      NATURE
    75. van Duijneveldt-van de Rijdt, JGCM; van Duijneveldt, FB
      Interaction optimized basis sets for correlated ab initio calculations on the water dimer

      JOURNAL OF CHEMICAL PHYSICS
    76. Sperry, DC; Midey, AJ; Lee, JI; Qian, J; Farrar, JM
      Spectroscopic studies of mass selected clusters of Sr+ solvated by H2O andD2O

      JOURNAL OF CHEMICAL PHYSICS
    77. Geleijns, M; van der Avoird, A
      Pseudorotation tunneling in several water trimer isotopomers

      JOURNAL OF CHEMICAL PHYSICS
    78. Nielsen, IMB; Seidl, ET; Janssen, CL
      Accurate structures and binding energies for small water clusters: The water trimer

      JOURNAL OF CHEMICAL PHYSICS
    79. Chen, HY; Sheu, WS
      Dipole-bound anion of water dimer: Theoretical ab-initio study

      JOURNAL OF CHEMICAL PHYSICS
    80. Baik, J; Kim, J; Majumdar, D; Kim, KS
      Structures, energetics, and spectra of fluoride-water clusters F-(H2O)(n),n = 1-6: Ab initio study

      JOURNAL OF CHEMICAL PHYSICS
    81. Graf, S; Mohr, W; Leutwyler, S
      An ab initio study of the torsional-puckering pseudorotation in the cyclicwater pentamer

      JOURNAL OF CHEMICAL PHYSICS
    82. Shin, DN; DeLeon, RL; Garvey, JF
      Multiphoton ionization of NO/CD3OH heteroclusters: Observation of [(NO)(n)(CD3O)(x)(CD3OH)(m)](+) cluster ions

      JOURNAL OF CHEMICAL PHYSICS
    83. Brockhaus, P; Hertel, IV; Schulz, CP
      Electronically excited states in size-selected solvated alkali metal atoms. III. Depletion spectroscopy of Na(NH3)(n)-clusters

      JOURNAL OF CHEMICAL PHYSICS
    84. Chang, HC; Jiang, JC; Chang, HC; Wang, YS; Lin, SH; Lee, YT
      On the search for H5O2+-centered water clusters in the gas phase

      JOURNAL OF THE CHINESE CHEMICAL SOCIETY
    85. Kryachko, ES
      Ab initio studies of the conformations of water hexamer: modelling the penta-coordinated hydrogen-bonded pattern in liquid water

      CHEMICAL PHYSICS LETTERS
    86. Sperry, DC; Lee, JI; Farrar, JM
      Cluster size specific chemistry: deuterium atom pickup in Sr+ solvated by ammonia

      CHEMICAL PHYSICS LETTERS
    87. Broude, S; Jung, JO; Gerber, RB
      Combined diffusion quantum Monte Carlo-vibrational self-consistent field (DQMC-VSCF) method for excited vibrational states of large polyatomic systems

      CHEMICAL PHYSICS LETTERS
    88. Blanton, WB; Gordon-Wylie, SW; Clark, GR; Jordan, KD; Wood, JT; Geiser, U; Collins, TJ
      Synthesis and crystallographic characterization of an octameric water complex, (H2O)(8)

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    89. DUKAN L; DELFABBRO L; PRADEL P; SUBLEMONTIER O; MESTDAGH JM; VISTICOT JP
      PHOTOFRAGMENTATION OF HYDRATED IRON IONS FE(H2O)(N)(-9) AT 532, 355 AND 266 NM() (N = 1)

      The European Physical Journal. D: Atomic, molecular and optical physics
    90. LU WY; YANG SH
      REACTIONS OF ALKALINE-EARTH METAL-IONS WITH METHANOL CLUSTERS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    91. CHOI JH; KUWATA KT; CAO YB; OKUMURA M
      VIBRATIONAL SPECTROSCOPY OF THE CL-(H2O)(N) ANIONIC CLUSTERS, N=1-5

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    92. ANGEL L; STACE AJ
      REACTIONS OF NO+ IN HETEROGENEOUS WATER CLUSTERS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    93. LIEDL KR; KROEMER RT
      HIGHLY ACCURATE ESTIMATES OF HYDROGEN-BOND ENERGIES RELYING ON BASIS-SET CONVERGENCE PATTERNS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    94. WORMALD CJ; MAYR JC
      BENZENE-DIMETHYL KETONE ASSOCIATION - EXCESS MOLAR ENTHALPY OF (CYCLOHEXANE PLUS DIMETHYL KETONE)(G) AND (BENZENE PLUS DIMETHYL KETONE)(G) FROM TEMPERATURES OF 353.2 TO 403.2 K

      Journal of the Chemical Society. Faraday transactions
    95. MASELLA M; GRESH N; FLAMENT JP
      A THEORETICAL-STUDY OF NONADDITIVE EFFECTS IN 4 WATER TETRAMERS

      Journal of the Chemical Society. Faraday transactions (Print)
    96. FEYBESSE JL; JOHAN V; TRIBOULET C; GUERROT C; MAYAGAMIKOLO F; BOUCHOT V; NDONG JE
      THE WEST CENTRAL AFRICAN BELT - A MODEL OF 2.5-2.0 GA ACCRETION AND 2-PHASE OROGENIC EVOLUTION

      Precambrian research
    97. WATANABE H; ASADA T
      HYBRID PROCEDURE OF THE AB-INITIO MOLECULAR-ORBITAL (MO) METHOD AND THE MONTE-CARLO SAMPLINGS - APPLICATION TO CLUSTER B+(H2O)

      Chemical physics
    98. Hagemeister, FC; Gruenloh, CJ; Zwier, TS
      Resonant ion-dip infrared spectroscopy of benzene-(water)(n)-(methanol)(m)clusters with n+m=4,5

      CHEMICAL PHYSICS
    99. Berg, C; Beyer, M; Achatz, U; Joos, S; Niedner-Schatteburg, G; Bondybey, VE
      Stability and reactivity of hydrated magnesium cations

      CHEMICAL PHYSICS
    100. France, MR; Pullins, SH; Duncan, MA
      Photodissociation of Mg+-(CH3OH)(N) complexes: evidence for the onset of solvation

      CHEMICAL PHYSICS


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Documento generato il 22/10/20 alle ore 20:49:59