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La ricerca find articoli where soggetti phrase all words 'INFRARED INTENSITIES' sort by level,fasc_key/DESCEND, pagina_ini_num/ASCEND ha restituito 180 riferimenti
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    1. Ludwig, R
      Water: From clusters to the bulk

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    2. 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
    3. Haiduke, RLA; Hase, Y; Bruns, RE
      The infrared fundamental intensities and polar tensor of allene

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    4. 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
    5. Cappelli, C; Corni, S; Tomasi, J
      Solvent effects on trans/gauche conformational equilibria of substituted chloroethanes: a polarizable continuum model study

      JOURNAL OF PHYSICAL CHEMISTRY A
    6. 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
    7. Qian, WL; Krimm, S
      Spectroscopically determined molecular mechanics model for the intermolecular interactions in hydrogen-bonded formic acid dimer structures

      JOURNAL OF PHYSICAL CHEMISTRY A
    8. Wysokinski, R; Michalska, D
      The performance of different density functional methods in the calculationof molecular structures and vibrational spectra of platinum(II) antitumor drugs: Cisplatin and carboplatin

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    9. Lee, SH; Palmo, K; Krimm, S
      The Casimir-Eckart condition and the transformation of dipole moment derivatives revisited

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    10. da Silva, JBP; Ramos, MN
      Factorial design analysis of the effects of wave function modifications oninfrared intensity parameters

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    11. Scarminioa, IS; Neto, BD; de Oliveira, AE; Haiduke, RLA; Bruns, RE
      An electronegativity model for the fundamental infrared intensities of thehalomethanes

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    12. Keefe, CD; Donovan, LA
      Optical constants, and vibrational assignment of liquid bromobenzene-d(5) between 4000 and 400 cm(-1) at 25 degrees C

      JOURNAL OF MOLECULAR STRUCTURE
    13. Keefe, CD
      Curvefitting imaginary components of optical properties: Restrictions on the lineshape due to causality

      JOURNAL OF MOLECULAR SPECTROSCOPY
    14. Mahoney, MW; Jorgensen, WL
      Quantum, intramolecular flexibility, and polarizability effects on the reproduction of the density anomaly of liquid water by simple potential functions

      JOURNAL OF CHEMICAL PHYSICS
    15. Demadis, KD; Hartshorn, CM; Meyer, TJ
      The localized-to-delocalized transition in mixed-valence chemistry

      CHEMICAL REVIEWS
    16. Max, JJ; de Blois, S; Veilleux, A; Chapados, C
      IR Spectroscopy of aqueous alkali halides. Factor analysis

      CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE
    17. Tackley, DR; Dent, G; Smith, WE
      IR and Raman assignments for zinc phthalocyanine from DFT calculations

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    18. de Oliveira, AE; Haiduke, RLA; Bruns, RE
      The infrared fundamental intensities and polar tensor of CF4

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    19. Picque, N; Guelachvili, G
      Emission spectra of HCN/HNC in the 2-5 mu m range of astrophysical interest

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    20. McKean, DC
      Quantum-chemical studies of fluoroethanes: Vibrational assignments, isolated CH stretching frequencies, valence force constants, and bond length relationships

      JOURNAL OF PHYSICAL CHEMISTRY A
    21. de Oliveira, AE; Haiduke, RLA; Bruns, RE
      Atomic mean dipole moment derivatives and GAPT charges

      JOURNAL OF PHYSICAL CHEMISTRY A
    22. Haiduke, RLA; de Oliveira, AE; Bruns, RE
      Simple potential models for carbon 1s ionization energies using infrared mean dipole moment derivatives

      JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA
    23. Fodi, B; McKean, DC; Palmer, MH
      The effects of fluorine and chlorine substitution on bond lengths in ethanes and disilanes: comparisons of ab initio and experimental information

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    24. Palmer, MH
      On the charge distribution in ethanes and disilanes and correlations with equilibrium bond lengths; an ab initio study

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    25. da Silva, JBP
      Application of factorial design for the ab initio study of cis- and trans-1,2 dihaloethylene stabilities

      JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY
    26. Domagalska, BW; Wilk, KA; Szymusiak, H; Zielinski, R
      New conjugated polyenes with 1,3-dialkyl-2-thiobarbituric acid moiety as materials for nonlinear optics: theoretical calculations, synthesis and spectral properties

      COMPUTERS & CHEMISTRY
    27. Russell, AJ; Spackman, MA
      An ab initio study of vibrational corrections to the electrical propertiesof the fluoromethanes: CH3F, CH2F2, CHF3 and CF4

      MOLECULAR PHYSICS
    28. Mandin, JY; Dana, V; Claveau, C
      Line intensities in the nu(5) band of acetylene (C2H2)-C-12

      JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER
    29. Bertie, JE; Apelblat, Y; Keefe, CD
      Infrared intensities of liquids. Part XXIII. Infrared optical constants and integrated intensities of liquid benzene-d(1) at 25 degrees C

      JOURNAL OF MOLECULAR STRUCTURE
    30. Misiaszek, T; Szostak, MM
      Atomic charge distribution in 4-isopropylphenol molecule derived from atomic polar tensors

      JOURNAL OF MOLECULAR STRUCTURE
    31. Gussoni, M; Castiglioni, C
      Infrared intensities. Use of the CH-stretching band intensity as a tool for evaluating the acidity of hydrogen atoms in hydrocarbons

      JOURNAL OF MOLECULAR STRUCTURE
    32. Castiglioni, C; Tommasini, M; Del Zoppo, M
      Experimental vibrational contributions to molecular hyperpolarisabilities:methods and measurements

      JOURNAL OF MOLECULAR STRUCTURE
    33. Cottaz, C; Kleiner, I; Tarrago, G; Brown, LR; Margolis, JS; Poynter, RL; Pickett, HM; Fouchet, T; Drossart, P; Lellouch, E
      Line positions and intensities in the 2 nu(2)/nu(4) vibrational system of (NH3)-N-14 near 5-7 mu m

      JOURNAL OF MOLECULAR SPECTROSCOPY
    34. Sherrill, CD; Byrd, EFC; Head-Gordon, M
      Complete basis set extrapolations for low-lying triplet electronic states of acetylene and vinylidene

      JOURNAL OF CHEMICAL PHYSICS
    35. Venables, DS; Schmuttenmaer, CA
      Spectroscopy and dynamics of mixtures of water with acetone, acetonitrile,and methanol

      JOURNAL OF CHEMICAL PHYSICS
    36. Mahoney, MW; Jorgensen, WL
      A five-site model for liquid water and the reproduction of the density anomaly by rigid, nonpolarizable potential functions

      JOURNAL OF CHEMICAL PHYSICS
    37. Hahn, S; Kim, D; Cho, MH
      Nonlinear optical properties of the linear quadrupolar molecule: Structure-function relationship based on a three-state model

      JOURNAL OF PHYSICAL CHEMISTRY B
    38. McKean, DCC
      Ab initio and density functional studies of the structure, vibrational spectra and force field of trimethylsilane

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    39. Di Lonardo, G; Fusina, L; Masciarelli, G; Tullini, F
      Integrated band strengths of benzene vapour in the 600-1900 cm(-l) region

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    40. Ford, TA; Steele, D
      On the computation of the dipole change arising from vibrational angular momentum and some inter-relationships between the elements of the atomic polar tensor

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    41. de Oliveira, AE; Bruns, RE
      CCl4: mean dipole moment derivatives and core electron binding energies

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    42. Tai, S; Papasavva, S; Kenny, JE; Gilbert, BD; Janni, JA; Steinfeld, JI; Taylor, JD; Weinstein, RD
      Reassignment of the vibrational spectra of CHF2CH3 (HFC-152a), CF3CH3 (HFC-143a), CF3CHF2 (HFC-125), and CHCl2CF3 (HCFC-123)

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    43. Fleischer, H; McKean, DC
      Ab initio studies of disilazanes: Structures and vibrational properties ofhexachloro-, hexamethyl-, and tetrachlorodisilazane

      JOURNAL OF PHYSICAL CHEMISTRY A
    44. Keefe, CD; Donovan, LA; Fleet, SD
      Vibrational assignment and dipole moment derivatives of liquid bromobenzene at 25 degrees C

      JOURNAL OF PHYSICAL CHEMISTRY A
    45. de Oliveira, AE; Guadagnini, PH; Haiduke, RLA; Bruns, RE
      A simple potential model criterion for the quality of atomic charges

      JOURNAL OF PHYSICAL CHEMISTRY A
    46. Cho, MH
      Vibrational properties and vibrational first-hyperpolarizability of an octupolar molecule based on a valence-bond three charge-transfer (VB-3CT) model

      JOURNAL OF PHYSICAL CHEMISTRY A
    47. Magdo, I; Nemeth, K; Mark, F; Hildebrandt, P; Schaffner, K
      Calculation of vibrational spectra of linear tetrapyrroles. 1. Global setsof scaling factors for force fields derived by ab initio and density functional theory

      JOURNAL OF PHYSICAL CHEMISTRY A
    48. Porezag, D; Pederson, MR
      Optimization of Gaussian basis sets for density-functional calculations

      PHYSICAL REVIEW A
    49. Guirgis, GA; Nashed, YE; Klaeboe, P; Aleksa, V; Durig, JR
      Conformational stability, Raman and infrared spectra, vibrational assignment, and ab initio calculations of allyltrifluorosilane

      STRUCTURAL CHEMISTRY
    50. Yu, SY
      Infrared absorption line intensities for U(5) model of linear triatomic molecules

      SCIENCE IN CHINA SERIES A-MATHEMATICS PHYSICS ASTRONOMY
    51. Lazzeretti, P; Caputo, MC; Ferraro, MB
      Thomas-Reiche-Kuhn populations in alkanes

      CHEMICAL PHYSICS
    52. Henchman, RH; Essex, JW
      Generation of OPLS-like charges from molecular electrostatic potential using restraints

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    53. Vladimiroff, T
      Ab initio calculations of the mean-square amplitudes of vibration for the fluoroethylenes

      JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
    54. Scarminio, IS; de Oliveira, AE; Bruns, RE
      Factorial design - principal component regression calculation of fundamental vibrational frequencies

      THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE
    55. Fleischer, H; McKean, DC; Parsons, S; Buhl, M
      Bis(dichlorosilyl)methylamine - Synthesis, crystal structure, and conformational analysis in the gas phase

      ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE
    56. Kjaergaard, HG; Bezar, KJ; Brooking, KA
      Calculation of dipole moment functions with density functional theory: application to vibrational band intensities

      MOLECULAR PHYSICS
    57. Rumi, M; Zerbi, G
      Conformational dependence of vibrational and molecular nonlinear optical properties in substituted benzenes: the role of pi-electron conjugation and back-donation

      JOURNAL OF MOLECULAR STRUCTURE
    58. Avila, G; Fernandez, JM; Mate, B; Tejeda, G; Montero, S
      Re-vibrational Raman cross sections of water vapor in the OH stretching region

      JOURNAL OF MOLECULAR SPECTROSCOPY
    59. Kleiner, I; Brown, LR; Tarrago, G; Kou, QL; Picque, N; Guelachvili, G; Dana, V; Mandin, JY
      Positions and intensities in the 2 nu(4)/nu(1)/nu(3) vibrational system of(NH3)-N-14 near 3 mu m

      JOURNAL OF MOLECULAR SPECTROSCOPY
    60. Halls, MD; Schlegel, HB
      Comparison study of the prediction of Raman intensities using electronic structure methods

      JOURNAL OF CHEMICAL PHYSICS
    61. Ivanov, OA; Akhmedzhanov, RA; Ivanova, LS
      Evolution of the products of destruction of an admixture of Freon-113 in air under the effect of nanosecond corona and microwave discharges

      HIGH TEMPERATURE
    62. Hey, MJ; Jackson, DP
      Attenuated total reflection FT-IR study of hydrogen bonding in water/ethermixtures

      CHEMICAL PHYSICS LETTERS
    63. Wyrowski, F; Schilke, P; Walmsley, CM
      Vibrationally excited HC3N toward hot cores

      ASTRONOMY AND ASTROPHYSICS
    64. Max, JJ; Chapados, C
      Influence of anomalous dispersion on the ATR spectra of aqueous solutions

      APPLIED SPECTROSCOPY
    65. Gorbaty, YE; Bondarenko, GV
      Experimental technique for quantitative IR studies of highly absorbing substances at high temperatures and pressures

      APPLIED SPECTROSCOPY
    66. NASCIMENTO IC; DEOLIVEIRA AE; BRUNS RE
      A STATISTICAL APPROACH OF DENSITY-FUNCTIONAL EFFECTS ON THE VIBRATIONAL FREQUENCIES AND INFRARED INTENSITIES OF CH3F

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    67. KARPFEN A
      AB-INITIO STUDIES ON CYANOACETYLENE OLIGOMERS - RINGS AND CHAINS VERSUS STACKED CLUSTERS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    68. TORII H; FURUYA K; TASUMI M
      RAMAN INTENSITIES INDUCED BY ELECTROSTATIC INTERMOLECULAR INTERACTIONAND RELATED NONLINEAR-OPTICAL PROPERTIES OF A CONJUGATED PI-ELECTRON SYSTEM - A THEORETICAL-STUDY

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    69. CHO M
      VIBRATIONAL CHARACTERISTICS AND VIBRATIONAL CONTRIBUTIONS TO THE NONLINEAR-OPTICAL PROPERTIES OF A PUSH-PULL POLYENE IN SOLUTION

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    70. GLUKHOVTSEV MN; BACH RD; NAGEL CJ
      A HIGH-LEVEL COMPUTATIONAL STUDY ON THE THERMOCHEMISTRY AND THERMAL-DECOMPOSITION OF SULFUR MUSTARD (2,2'-DICHLOROETHYL SULFIDE) - A CHEMICAL WARFARE AGENT

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    71. GUIRGIS GA; NASHED YE; GOUNEV TK; DURIG JR
      CONFORMATIONAL STABILITY, STRUCTURAL PARAMETERS, VIBRATIONAL FREQUENCIES, AND RAMAN AND INFRARED INTENSITIES OF ALLYLSILANE

      Structural chemistry
    72. PALMO K; KRIMM S
      ELECTROSTATIC MODEL FOR INFRARED INTENSITIES IN A SPECTROSCOPICALLY DETERMINED MOLECULAR MECHANICS FORCE-FIELD

      Journal of computational chemistry
    73. FURUYA K; TORII H; FURUKAWA Y; TASUMI M
      DENSITY-FUNCTIONAL STUDY ON THE STRUCTURES AND VIBRATIONAL-SPECTRA OFTHE RADICAL-ANION AND CATION OF BIPHENYL

      Journal of molecular structure. Theochem
    74. PIECUCH P; SPIRKO V; PALDUS J
      DIPOLE-MOMENT AND POLARIZABILITY FUNCTIONS OF AMMONIA - A LINEAR-RESPONSE COUPLED-CLUSTER STUDY

      Polish Journal of Chemistry
    75. MATHIEU D; GRAND A
      AB-INITIO HARTREE-FOCK RAMAN-SPECTRA OF POLYACRYLONITRILE

      Polymer
    76. GUSSONI M; RUI M; ZERBI G
      ELECTRONIC AND RELAXATION CONTRIBUTION TO LINEAR MOLECULAR POLARIZABILITY - AN ANALYSIS OF THE EXPERIMENTAL VALUES

      Journal of molecular structure
    77. CHACKERIAN C; BROWN LR; LACOME N; TARRAGO G
      METHYL-CHLORIDE NU(5) REGION LINESHAPE PARAMETERS AND ROTATIONAL-CONSTANTS FOR THE NU(2), NU(5), AND 2-NU(3) VIBRATIONAL BANDS

      Journal of molecular spectroscopy (Print)
    78. CABALEIROLAGO EM; RIOS MA
      POTENTIAL FUNCTIONS FOR DESCRIBING INTERMOLECULAR INTERACTIONS IN CYANOACETYLENE CLUSTERS

      The Journal of chemical physics
    79. CABALEIROLAGO EM; RIOS MA
      DEVELOPMENT OF A POTENTIAL FUNCTION FOR DESCRIBING THE PROPERTIES OF HCN CLUSTERS

      The Journal of chemical physics
    80. DELZOPPO M; CASTIGLIONI C; ZULIANI P; RAZELLI A; TOMMASINI M; ZERBI G; BLANCHARDDESCE M
      USE OF VIBRATIONAL-SPECTRA FOR THE DETERMINATION OF FIRST-ORDER MOLECULAR HYPERPOLARIZABILITIES OF PUSH-PULL POLYENES AS FUNCTION OF STRUCTURAL PARAMETERS

      Journal of applied polymer science
    81. GALABOV B; DUDEV T; ILIEVA S; DURIG JR
      CREATION OF INTENSITY THEORY IN VIBRATIONAL SPECTROSCOPY - KEY ROLE OF AB-INITIO QUANTUM-MECHANICAL CALCULATIONS

      International journal of quantum chemistry
    82. ADCOCK W; BRUNGER MJ; MICHALEWICZ MT; WINKLER DA
      APPLICATION OF DFT AND EMS TO THE STUDY OF STRAINED ORGANIC-MOLECULES

      Australian journal of physics
    83. KEEFE CD; PITTMAN J
      OPTICAL-CONSTANTS AND DIPOLE-MOMENT DERIVATIVES OF BROMOBENZENE BETWEEN 3200 AND 400 CM(-1) AT 25-DEGREES-C

      Applied spectroscopy
    84. PARENTE V; FREDRIKSSON C; SELMANI A; LAZZARONI R; BREDAS JL
      THEORETICAL CHARACTERIZATION OF THE VIBRATIONAL PROPERTIES AT THE ALUMINUM TRANSPOLYACETYLENE INTERFACE/

      JOURNAL OF PHYSICAL CHEMISTRY B
    85. KELLOGG CB; SCHAEFER HF
      COUPLED-CLUSTER VIBRATIONAL FREQUENCIES FOR OPEN, RING AND SUPEROXIDESULFUR-DIOXIDE

      Theoretical chemistry accounts
    86. BAUSCHLICHER CW; LANGHOFF SR
      THE CALCULATION OF ACCURATE HARMONIC FREQUENCIES OF LARGE MOLECULES -THE POLYCYCLIC AROMATIC-HYDROCARBONS, A CASE-STUDY

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    87. DASILVA JBP; RAMOS MN; BRUNS RE
      EFFECTS OF WAVE-FUNCTION MODIFICATIONS ON CALCULATED C-H VIBRATIONAL FREQUENCIES AND INFRARED INTENSITIES OF THE DIHALOETHYLENES

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    88. RAMOS MN; DASILVA JBP; BRUNS RE
      EFFECTS OF WAVE-FUNCTION MODIFICATIONS ON CALCULATED C-F AND C-CL VIBRATIONAL FREQUENCIES AND INFRARED INTENSITIES OF THE DIHALOETHYLENES

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    89. MARTINS HP; BRUNS RE
      INFRARED VIBRATIONAL INTENSITIES AND POLAR TENSORS OF THE CARBONYL AND THIOCARBONYL HALIDES

      SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
    90. VANHUIS TJ; YAMAGUCHI Y; SHERRILL CD; SCHAEFER HF
      (X)OVER-TILDE(1)A(1), (A)OVER-TILDE(3)B(1), (A)OVER-TILDE(1)B(1), AND(B)OVER-TILDE(1)A(1) ELECTRONIC STATES OF PH2+

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    91. DASILVA JBP; RAMOS MN; SUTO E; BRUNS RE
      TRANSFERABILITY OF THE CIS-DICHLOROETHYLENE AND TRANS-DICHLOROETHYLENE ATOMIC POLAR TENSORS

      The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
    92. PAPASAVVA S; ILLINGER KH; KENNY JE
      MOLECULAR-PROPERTIES OF CFC SUBSTITUTES FROM AB-INITIO CALCULATIONS -CFCL2CH3, CF2CLCH3, CHCL2CF3 AND CHFCLCF3

      Journal of molecular structure. Theochem
    93. KJAERGAARD HG; DAUB CD; HENRY BR
      THE ROLE OF ELECTRON CORRELATION ON CALCULATED XH-STRETCHING VIBRATIONAL BAND INTENSITIES

      Molecular physics
    94. BERTIE JE
      QUANTITATIVE INFRARED INTENSITIES OF NEAT LIQUIDS - THEIR MEASUREMENTAND USE

      Mikrochimica acta
    95. DELZOPPO M; CASTIGLIONI C; ZULIANI P; ZERBI G
      FROM VIBRATIONAL INTENSITY SPECTROSCOPY TO NONLINEAR-OPTICAL PROPERTIES OF ORGANIC-MOLECULES IN ELECTRONICS AND PHOTONICS

      Mikrochimica acta
    96. BERTIE JE; APELBLAT Y
      ABSOLUTE INFRARED INTENSITIES OF BINARY-MIXTURES OF LIQUID CHLOROBENZENE AND TOLUENE

      Mikrochimica acta
    97. FISCHER WB; EYSEL HH
      RAMAN AND FTIR SPECTROSCOPIC STUDY ON WATER STRUCTURAL-CHANGES IN AQUEOUS-SOLUTIONS OF AMINO-ACIDS AND RELATED-COMPOUNDS

      Journal of molecular structure
    98. KERESZTURY G; PAIZS B
      THE QUALITY OF AB-INITIO QUANTUM-MECHANICAL PREDICTION OF VIBRATIONALTRANSITION DIPOLE DIRECTIONS AND INFRARED INTENSITIES

      Journal of molecular structure
    99. GALABOV B; DUDEV T; ILIEVA S
      EFFECTIVE BOND CHARGES FROM INFRARED AND RAMAN INTENSITIES

      Journal of molecular structure
    100. LEININGER ML; SCHAEFER HF
      MOLECULAR-GEOMETRY AND VIBRATIONAL FREQUENCIES OF OZONE FROM COMPACT VARIATIONAL WAVE-FUNCTIONS EXPLICITLY INCLUDING TRIPLE AND QUADRUPLE SUBSTITUTIONS

      The Journal of chemical physics


ASDD Area Sistemi Dipartimentali e Documentali, Università di Bologna, Catalogo delle riviste ed altri periodici
Documento generato il 06/06/20 alle ore 00:05:38