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    1. Ahmed, SM; Ahmed, SA
      Geometrical stability and energy storage of some conducting large aromaticsulfonate-doped polyaniline

      EUROPEAN POLYMER JOURNAL
    2. Bureau, C; Doneux, C; Charlier, J; Anthoine, JL; Chong, DP
      Ring hydrolysis in the electro-oxidation of pyrrolidone analogues

      JOURNAL OF ELECTROANALYTICAL CHEMISTRY
    3. Shestakova, AK; Chertkov, VA; Schneider, HJ; Lysenko, KA
      A first comparison of solid state and solution structure of a complex between lanthanum nitrate and 1,9-diaza-18-crown-6

      ORGANIC LETTERS
    4. Borowski, T; Krol, M; Chruszcz, M; Broclawik, E
      First principle calculations for the non-heme iron centers of lipoxygenases: Geometrical and spectral properties

      JOURNAL OF PHYSICAL CHEMISTRY B
    5. 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
    6. Li, XF; Cai, ZL; Sevilla, MD
      Investigation of proton transfer within DNA base pair anion and cation radicals by density functional theory (DFT)

      JOURNAL OF PHYSICAL CHEMISTRY B
    7. Ayala, R; Marcos, ES; Diaz-Moreno, S; Sole, VA; Munoz-Paez, A
      Geometry and hydration structure of Pt(II) square planar complexes [Pt(H2O)(4)](2+) and [PtCl4](2-) as studied by X-ray absorption spectroscopies andquantum-mechanical computations

      JOURNAL OF PHYSICAL CHEMISTRY B
    8. Horvat, SM; Schiesser, CH
      Polysilane and related radical rearrangements: an ab initio study of (1,2)-silyl, germyl and stannyl translocations in radicals derived from trisilanes and related species

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    9. Dua, S; Bowie, JH
      A novel anion rearrangement. The conversion of [CC(O)(CN)](-) to [NCCCO](-) in the gas phase: a joint experimental and theoretical study

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    10. Tahmassebi, D
      Substituent effects on the stability of carbodiimides

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    11. Munoz, JL; Garcia-Herrero, A; Asensio, JL; Auzennaeau, FI; Canada, FJ; Jimenez-Barbero, J
      Conformational selection of non-hydrolyzable glycomimetics: the conformation of N,N '-diacetylthiochitobiose bound to wheat germ agglutinin

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1
    12. Caballero, A; Gomez-de la Torre, F; Jalon, FA; Manzano, BR; Rodriguez, AM; Trofimenko, S; Sigalas, MP
      Synthesis and characterisation of a series of ruthenium scorpionate complexes with B-H center dot center dot center dot M agostic nteractions. Crystal structure of [RuH(kappa(2)-N,BH Tp(Tn))(PMe3)(cod)] (Tp(Tn) = hydrotris[3-(2-thienyl)pyrazol-1-yl]borate)

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    13. Schimmelpfennig, B; Wahlgren, U; Gropen, O; Haaland, A
      The gas phase structures of tungsten chlorides: density functional theory calculations on WCl6, WCl5, WCl4, WCl3 and W2Cl6

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    14. D'Anna, B; Langer, S; Ljungstrom, E; Nielsen, CJ; Ullerstam, M
      Rate coefficients and Arrhenius parameters for the reaction of the NO3 radical with acetaldehyde and acetaldehyde-1d

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    15. Cao, ZX; Peyerimhoff, SD
      Electronic spectra of linear isoelectronic species HC6H+, C6H, HC5N+

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    16. Kuroda, Y; Kumashiro, R; Itadani, A; Nagao, M; Kobayashi, H
      A more efficient copper-ion-exchanged ZSM-5 zeolite for N-2 adsorption at room temperature: Ion-exchange in an aqueous solution of Cu(CH3COO)(2)

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    17. Lischka, H; Shepard, R; Pitzer, RM; Shavitt, I; Dallos, M; Muller, T; Szalay, PG; Seth, M; Kedziora, GS; Yabushita, S; Zhang, ZY
      High-level multireference methods in the quantum-chemistry program system COLUMBUS: Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin-orbit CI and parallel CI density

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    18. Ohrn, A; Christiansen, O
      Electronic excitation energies of pyrimidine studied using coupled clusterresponse theory

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    19. Leonard, C; Chambaud, G; Rosmus, P; Carter, S; Handy, NC
      The selective population of the vibrational levels of thioformaldehyde

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    20. Yu, YX; Han, MH; Gao, GH
      Self-diffusion in a fluid of square-well spheres

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    21. Toniolo, A; Granucci, G; Inglese, S; Persico, M
      Theoretical study of the photodissociation dynamics of ClOOCl

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    22. Lin, H; He, SG; Wang, XG; Yuan, LF; Burger, H; D'Eu, JF; Reuter, N; Thiel, W
      The vibrational overtones of SiH4 isotopomers: experimental wavenumbers, assignment, ab initio dipole moment surfaces and intensities

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    23. Auer, AA; Gauss, J
      Equilibrium structure and fundamental frequencies of allene

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    24. Botschwina, P; Stoll, H
      The hydrogen-bonded cluster anions Br-center dot center dot center dot HCCH and I-center dot center dot center dot HCCH: results of coupled cluster calculations

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    25. Cook, PA; Ashfold, MNR; Jee, YJ; Jung, KH; Harich, S; Yang, XM
      Vacuum ultraviolet photochemistry of methane, silane and germane

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    26. Renold, S; Plibersek, S; Stoll, EP; Claxton, TA; Meier, PF
      First-principles calculation of electric field gradients and hyperfine couplings in YBa2CU3O7

      EUROPEAN PHYSICAL JOURNAL B
    27. Jodicke, T; Menges, F; Kehr, G; Erker, G; Howeler, U; Frohlich, R
      Conformational features of group-4 ansa-metallocenes with long -(CH2)(n) -Chains connecting their cyclopentadienyl ligands

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    28. Schneider, JJ; Spickermann, D; Blaser, D; Boese, R; Rademacher, P; Labahn, T; Magull, J; Janiak, C; Seidel, N; Jacob, K
      A pi-stacked organometallic propeller: Experimental and theoretical studies on reactivity and bonding in the pi-arene-bridged nickel triple-decker [{(eta(5)-Me4EtC5)Ni}(2)(mu-eta(3):eta(3)-decacyclene)]

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    29. Narbutt, J; Czerwinski, M; Krejzler, J
      Seven-coordinate d(0) and d(10) ions - Computational and experimental studies on tris(tropolonato)metal(III)-TOPO adducts

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    30. Schatzschneider, U; Weyhermuller, T; Rentschler, E
      Metal complexes with nitronyl nitroxide substituted phenolate ligands providing new magnetic exchange interaction pathways - Synthesis, structures, magnetic dilution studies, and ab initio calculations

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    31. Buhl, M; Terstegen, F; Loffler, F; Meynhardt, B; Kierse, S; Muller, M; Nather, C; Luning, U
      On the mechanism and stereoselectivity of the copper(I)-catalyzed cyclopropanation of olefins - A combined experimental and density functional study

      EUROPEAN JOURNAL OF ORGANIC CHEMISTRY
    32. Haenel, MW; Oevers, S; Angermund, K; Kaska, WC; Fan, HJ; Hall, MB
      Thermally stable homogeneous catalysts for alkane dehydrogenation

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    33. Bartolome, C; de Blas, R; Espinet, P; Martin-Alvarez, JM; Villafane, F
      Self-assembly of pyramidal tetrapalladium complexes with a halide at the apex

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    34. Czerwinski, M; Matusiewicz, M
      Comparison of magnetic and thermal properties of prismane and double-cubane [Fe6S6](4+) superclusters

      THEORETICAL CHEMISTRY ACCOUNTS
    35. Jaszunski, M; Rizzo, A; Jorgensen, P
      Coupled-cluster calculation of dispersion contributions to interaction energies and polarizabilities

      THEORETICAL CHEMISTRY ACCOUNTS
    36. Sekiya, M; Noro, T; Osanai, Y; Koga, T
      Contracted polarization functions for the atoms Ca, Ga-Kr, Sr, and In-Xe

      THEORETICAL CHEMISTRY ACCOUNTS
    37. Masamura, M
      The effect of basis set superposition error on the convergence of interaction energies

      THEORETICAL CHEMISTRY ACCOUNTS
    38. Ricca, A; Bauschlicher, CW
      A correlation-consistent basis set for Fe

      THEORETICAL CHEMISTRY ACCOUNTS
    39. Halls, MD; Velkovski, J; Schlegel, HB
      Harmonic frequency scaling factors for Hartree-Fock, S-VWN, B-LYP, B3-LYP,B3-PW91 and MP2 with the Sadlej pVTZ electric property basis set

      THEORETICAL CHEMISTRY ACCOUNTS
    40. Cooper, DL
      Spin-coupled description of the chemical bonding to hypercoordinate chlorine

      THEORETICAL CHEMISTRY ACCOUNTS
    41. Fejes, I; Billes, F
      Investigation of the structure of chalcogenide glasses

      MAGYAR KEMIAI FOLYOIRAT
    42. Bourcier, S; Bouchonnet, S; Hoppilliard, Y
      Ionization of 2,5-dihydroxybenzoic acid (DHB) matrix-assisted laser desorption ionization experiments and theoretical study

      INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
    43. Martin, JML
      A fully ab initio potential curve of near-spectroscopic quality for OH- ion: importance of connected quadruple excitations and scalar relativistic effects

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    44. Martins, HP; Fo; de Oliveira, AE; Haiduke, RLA; Bruns, RE
      The infrared intensities and polar tensors of the fluorochloromethanes

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    45. Fang, DC; Harding, LB; Klippenstein, SJ; Miller, JA
      A direct transition state theory based analysis of the branching in NH2+NO

      FARADAY DISCUSSIONS
    46. Haber, T; Schmitt, U; Emmeluth, C; Suhm, MA
      Ragout-jet FTIR spectroscopy of cluster isomerism and cluster dynamics: from carboxylic acid dimers to N2O nanoparticles

      FARADAY DISCUSSIONS
    47. Lester, MI; Pond, BV; Marshall, MD; Anderson, DT; Harding, LB; Wagner, AF
      Mapping the OH+CO -> HOCO reaction pathway through IR spectroscopy of the OH-CO reactant complex

      FARADAY DISCUSSIONS
    48. Tan, XF; Dagdigian, PJ; Alexander, MH
      Electronic spectroscopy and excited state dynamics of the Al-H-2/D-2 complex

      FARADAY DISCUSSIONS
    49. Botschwina, P; Dutoi, T; Mladenovic, M; Oswald, R; Schmatz, S; Stoll, H
      Theoretical investigations of proton-bound cluster ions

      FARADAY DISCUSSIONS
    50. Pompe, M; Veber, M
      Prediction of rate constants for the reaction of O-3 with different organic compounds

      ATMOSPHERIC ENVIRONMENT
    51. Foix, D; Gonbeau, D; Taillades, G; Pradel, A; Ribes, M
      The structure of ionically conductive chalcogenide glasses: a combined NMR, XPS and ab initio calculation study

      SOLID STATE SCIENCES
    52. Matsuwaki, T; Nakajima, T; Yamashita, K
      Density functional study on the adsorption of DMAH on hydrogen terminated Si(111) surfaces

      JOURNAL DE PHYSIQUE IV
    53. Rizopoulos, AL; Sigalas, MP
      Central metal dependence of the NO+-NO- isomerism in pentacoordinate MX(CO)(NO)(PR3)(2) complexes

      NEW JOURNAL OF CHEMISTRY
    54. Blasco, S; Demachy, I; Jean, Y; Lledos, A
      DFT study of the structural and redox properties of [Cp2Fe2S4](q) complexes (q=0,+2,+1 and-2)

      NEW JOURNAL OF CHEMISTRY
    55. Lamsabhi, AM; Bouab, W; Esseffar, M; Alcami, M; Yanez, M; Abboud, JLM
      Basicity of some carbonyl compounds towards iodine monochloride: experimental and theoretical study

      NEW JOURNAL OF CHEMISTRY
    56. Marchenko, AV; Gerard, H; Eisenstein, O; Caulton, KG
      A comparative study of olefin or acetylene insertion into Ru-H or Os-H of MHCl(CO)(phosphine)(2)

      NEW JOURNAL OF CHEMISTRY
    57. Moigno, D; Kiefer, W; Callejas-Gaspar, B; Gil-Rubio, J; Werner, H
      Metal-carbon vibrational modes as a probe of the trans influence in vinylidene and carbonyl rhodium(I) complexes

      NEW JOURNAL OF CHEMISTRY
    58. Marchenko, AV; Gerard, H; Eisenstein, O; Caulton, KG
      A comprehensive view of M-H addition across the RC CH bond: frustration culminating in ultimate union

      NEW JOURNAL OF CHEMISTRY
    59. Chiang, SY; Lee, YC; Lee, YP
      Formation of CH3CFCl+ from photoionization of CH3CFCl2: An application of threshold photoelectron photoion coincidence (TPEPICO) technique

      JOURNAL OF PHYSICAL CHEMISTRY A
    60. Ciofini, I; Adamo, C
      Intrinsic and environmental effects on the kinetic and thermodynamics of linkage isomerization in nitritopentaamminecobalt(III) complex

      JOURNAL OF PHYSICAL CHEMISTRY A
    61. Parthiban, S; de Oliveira, G; Martin, JML
      Benchmark ab initio energy profiles for the gas-phase S(N)2 reactions Y-+CH3X -> CH3Y+X- (X,Y = F,Cl,Br). Validation of hybrid DFT methods

      JOURNAL OF PHYSICAL CHEMISTRY A
    62. Del Bene, JE; Perera, SA; Bartlett, RJ
      What parameters determine N-N and O-O coupling constants ((2h)Jx-x) acrossX-H+-X hydrogen bonds?

      JOURNAL OF PHYSICAL CHEMISTRY A
    63. Nakajima, T; Kato, S
      Theoretical study of the effect of the intermolecular spin-orbit interaction in the collision-induced intersystem crossing of S-1 state glyoxal by Ar

      JOURNAL OF PHYSICAL CHEMISTRY A
    64. Mineva, T; Russo, N; Freund, HJ
      CO interaction with small rhodium clusters from density functional theory:Spectroscopic properties and bonding analysis

      JOURNAL OF PHYSICAL CHEMISTRY A
    65. Dreuw, A; Cederbaum, LS
      Electron emission from N(BF3)(4)(3-) hindered by a sphere of negative charges

      JOURNAL OF PHYSICAL CHEMISTRY A
    66. Flores, JR; Gomez, FJ
      A theoretical study of the S+C3H reaction: Potential energy surfaces

      JOURNAL OF PHYSICAL CHEMISTRY A
    67. Winkler, M; Sander, W
      The structure of meta-benzyne revisited - A close look into sigma-bond formation

      JOURNAL OF PHYSICAL CHEMISTRY A
    68. Freeman, F; Kasner, ML; Hehre, WJ
      An ab initio theory and density functional theory (DFT) study of conformers of tetrahydro-2H-pyran

      JOURNAL OF PHYSICAL CHEMISTRY A
    69. Peppe, S; Dua, S; Bowie, JH
      Is the elusive trioxydehydroethene neutral (O2C-CO) detectable in the gas phase?

      JOURNAL OF PHYSICAL CHEMISTRY A
    70. Ventura, ON; Kieninger, M; Denis, PA; Cachau, RE
      Density functional computational thermochemistry: Isomerization of sulfineand its enthalpy of formation

      JOURNAL OF PHYSICAL CHEMISTRY A
    71. Bachrach, SM; Hayes, JM; Check, CE; Sunderlin, LS
      Potential energy surface of SOCl3-

      JOURNAL OF PHYSICAL CHEMISTRY A
    72. Gruning, M; Gritsenko, OV; van Gisbergen, SJA; Baerends, EJ
      The failure of generalized gradient approximations (GGAs) and meta-GGAs for the two-center three-electron bonds in He-2(+), (H2O)(2)(+), and (NH3)(2)(+)

      JOURNAL OF PHYSICAL CHEMISTRY A
    73. Vargas, R; Garza, J; Dixon, D; Hay, BP
      C(sp(2))-C(aryl) bond rotation barrier in N-methylbenzamide

      JOURNAL OF PHYSICAL CHEMISTRY A
    74. Mitric, R; Hartmann, M; Stanca, B; Bonacic-Koutecky, V; Fantucci, P
      Ab initio adiabatic dynamics combined with Wigner distribution approach tofemtosecond pump-probe negative ion to neutral to positive ion (NeNePo) spectroscopy of Ag2Au, Ag-4, and Au-4 clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    75. Del Bene, JE; Jordan, MJT; Perera, SA; Bartlett, RJ
      Vibrational effects on the F-F spin-spin coupling constant ((2h)J(F-F)) inFHF- and FDF-

      JOURNAL OF PHYSICAL CHEMISTRY A
    76. Lee, EPF; Soldan, P; Wright, TG
      Structure and binding energies of monohydrated Cd and Cd2+

      JOURNAL OF PHYSICAL CHEMISTRY A
    77. Chaban, GM; Gerber, RB; Janda, KC
      Transition from hydrogen bonding to ionization in (HCl)(n)(NH3)(n) and (HCl)n(H2O)(n) clusters: Consequences or anharmonic vibrational spectroscopy

      JOURNAL OF PHYSICAL CHEMISTRY A
    78. Marcy, TP; Diaz, RR; Heard, D; Leone, SR; Harding, LB; Klippenstein, SJ
      Theoretical and experimental investigation of the dynamics of the production of CO from the CH3+O and CD3+O reactions

      JOURNAL OF PHYSICAL CHEMISTRY A
    79. Koput, J; Dutkiewicz, Z
      Equilibrium structure, spectroscopic constants, and gas-phase basicity of the silaformyl anion, HSiO-

      JOURNAL OF PHYSICAL CHEMISTRY A
    80. Citra, A; Wang, XF; Bare, WD; Andrews, L
      Reactions of laser-ablated platinum with nitrogen: Matrix infrared spectraof platinum nitride, complexes, and anions

      JOURNAL OF PHYSICAL CHEMISTRY A
    81. Derosa, PA; Seminario, JM; Balbuena, PB
      Properties of small bimetallic Ni-Cu clusters

      JOURNAL OF PHYSICAL CHEMISTRY A
    82. Kenny, JP; Krueger, KM; Rienstra-Kiracofe, JC; Schaefer, HF
      C5H4: Pyramidane and its low-lying isomers

      JOURNAL OF PHYSICAL CHEMISTRY A
    83. Politzer, P; Lane, P; Grice, ME
      Energetics of aluminum combustion

      JOURNAL OF PHYSICAL CHEMISTRY A
    84. Williams, HL; Chabalowski, CF
      Using Kohn-Sham orbitals in symmetry-adapted perturbation theory to investigate intermolecular interactions

      JOURNAL OF PHYSICAL CHEMISTRY A
    85. Broquier, M; Lahmani, F; Zehnacker-Rentien, A; Brenner, V; Millie, P; Peremans, A
      Hydrogen-bonded bridges in complexes of o-cyanophenol: Laser-induced fluorescence and IR/UV double-resonance studies

      JOURNAL OF PHYSICAL CHEMISTRY A
    86. Barrientos, C; Cimas, A; Largo, A
      Structure and stability of AlC2N isomers: A comparative ab initio and DFT study

      JOURNAL OF PHYSICAL CHEMISTRY A
    87. Goebel, JR; Ault, BS; Del Bene, JE
      Matrix isolation and ab initio study of 1 : 1 hydrogen-bonded complexes ofH2O2 with NH3 and N(CH3)(3)

      JOURNAL OF PHYSICAL CHEMISTRY A
    88. Balabanov, NB; Boggs, JE
      Lowest singlet and triplet states of copper, silver, and gold trihydrides:an ab initio study

      JOURNAL OF PHYSICAL CHEMISTRY A
    89. McCarren, PR; Gordon, MT; Lowary, TL; Hadad, CM
      Computational studies of the arabinofuranose ring: Conformational preferences of fully relaxed methyl alpha-D-arabinofuranoside

      JOURNAL OF PHYSICAL CHEMISTRY A
    90. Martinez-Nunez, E; Varandas, AJC
      Single-valued DMBE potential energy surface for HSO: A distributed n-body polynomial approach

      JOURNAL OF PHYSICAL CHEMISTRY A
    91. Rodriguez-Santiago, L; Sodupe, M; Tortajada, J
      Gas-phase reactivity of Ni+ with glycine

      JOURNAL OF PHYSICAL CHEMISTRY A
    92. Chapman, K; Crittenden, D; Bevitt, J; Jordan, MJT; Del Bene, JE
      Relating environmental effects and structures, IR, and NMR properties of hydrogen-bonded complexes: ClH : pyridine

      JOURNAL OF PHYSICAL CHEMISTRY A
    93. Matsuzawa, NN; Ishitani, A; Dixon, DA; Uda, T
      Time-dependent density functional theory calculations of photoabsorption spectra in the vacuum ultraviolet region

      JOURNAL OF PHYSICAL CHEMISTRY A
    94. Woodcock, HL; Wesolowski, SS; Yamaguchi, Y; Schaefer, HF
      A systematic study of the (X)over-tilde B-2(1), (A)over-bar (2)A(1), and (B)over-bar B-2(2) states of the neutral radical PH2

      JOURNAL OF PHYSICAL CHEMISTRY A
    95. Reva, ID; Stepanian, SG; Adamowicz, L; Fausto, R
      Combined FTIR matrix isolation and ab initio studies of pyruvic acid: Proof for existence of the second conformer

      JOURNAL OF PHYSICAL CHEMISTRY A
    96. Fast, PL; Schultz, NE; Truhlar, DG
      Multi-coefficient correlation method: Comparison of specific-range reaction parameters to general parameters for CnHxOy compounds

      JOURNAL OF PHYSICAL CHEMISTRY A
    97. Citra, A; Andrews, L
      A spectroscopic and theoretical investigation of charge transfer complexesbetween silver and nitric oxide: Infrared spectra and density functional calculations of AgNO+,0,- and Ag-x(NO)(y) clusters (x, y=1, 2) in solid argon and neon

      JOURNAL OF PHYSICAL CHEMISTRY A
    98. Bevitt, J; Chapman, K; Crittenden, D; Jordan, MJT; Del Bene, JE
      An ab initio study of anharmonicity and field effects in hydrogen-bonded complexes of the deuterated analogues of HCl and HBr with NH3 and N(CH3)(3)

      JOURNAL OF PHYSICAL CHEMISTRY A
    99. Valeev, EF; Allen, WD; East, ALL; Csaszar, AG; East, ALL
      Interlocking triplet electronic states of isocyanic acid: Sources of nonadiabatic photofragmentation dynamics

      JOURNAL OF PHYSICAL CHEMISTRY A
    100. Thurman, GM; Steckler, R
      Ab initio direct dynamics study of OOH+H -> H-2+O-3(2)

      JOURNAL OF PHYSICAL CHEMISTRY A


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Documento generato il 12/08/20 alle ore 00:06:37