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Raman spectroscopic study of water structure in aqueous nonionic surfactant solutions
JOURNAL OF PHYSICAL CHEMISTRY B
Spectral and kinetic fluorescence properties of native and nonisomerizing retinal in bacteriorhodopsin
CHEMPHYSCHEM
A study of the possible and preferred site of protonation in 7-methyl-1,5,7-triazabicyclo[4,4,0]dec-5-ene by vibrational spectroscopic methods
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
Study of the perpendicular band intensities of the CH chromophore in CHCl3, CHBr3, and CHI3 with three-dimensional dipole moment surface from densityfunctional calculations
JOURNAL OF PHYSICAL CHEMISTRY A
Infrared spectrum of the palladium nitrosyl complex isolated in solid argon
JOURNAL OF PHYSICAL CHEMISTRY A
Conical intersections: The new conventional wisdom
JOURNAL OF PHYSICAL CHEMISTRY A
Laser spectroscopy of small molecules
ADVANCES IN ATOMIC, MOLECULAR, AND OPTICAL PHYSICS, VOL 45
High-resolution analysis of the nu(2)+2 nu(3) band of HDO
CHINESE PHYSICS
Inelastic electron tunneling spectroscopy: Spectroscopy using a phenomenonof electron tunneling (Review)
BUNSEKI KAGAKU
Infrared and Raman spectra of Hg2MoO4 and Hg2WO4
JOURNAL OF RAMAN SPECTROSCOPY
Quantum chemical investigation of silicon-sulfur clusters [(SiS2)(n)S](-) (n=1-4)
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
Revisiting the Generator Coordinate Approximation for calculating the Ro-vibrational energies of H-3(+)
JOURNAL OF COMPUTATIONAL CHEMISTRY
Solids modeled by ab initio crystal field methods. Part 19. Structure of yellow and light yellow form of dimethyl 3,6-dichloro-2, 5-dihydroxyterephthalate
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Ab initio study on the structural features of icosahedral carboranes containing heteroatoms
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
DFT study of alpha-alanine as a function of the medium polarity
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Review: Spectroscopic studies of oxovanadium coordination compounds
JOURNAL OF COORDINATION CHEMISTRY
The molecular adsorption of CO on the Ru(11(2)over-bar-0) surface
SURFACE SCIENCE
Overtone spectrum and the Fermi resonance of the SiH chromophore in SiHCl3
MOLECULAR PHYSICS
Some simple mechanisms of multiphoton excitation in many-level systems
MOLECULAR PHYSICS
Structure and vibrational spectra of conjugated acids of trans- and cis-azobenzene
JOURNAL OF MOLECULAR STRUCTURE
Ab initio calculations of the structural, energetic, and vibrational properties of some hydrogen bonded and van der Waals dimers. Part 4. The acetonitrile dimer
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
Preparation and characterization of bis(trifluoromethyl)phosphanide salts of outstanding stability
INORGANIC CHEMISTRY
Synthesis and characterization of six new quaternary actinide thiophosphate compounds: Cs8U5(P3S10)(2)(PS4)(6), K10Th3(P2S7)(4)(PS4)(2), and A(5)An(PS4)(3), (A = K, Rb, Cs; An = U, Th)
INORGANIC CHEMISTRY
Study of interaction between aspartic acid and silver by surface-enhanced Raman scattering on H2O and D2O sols
BIOPOLYMERS
Franck-Condon simulation of the S-1 -> S-0 spectrum of phenol
JOURNAL OF PHYSICAL CHEMISTRY A
Methyl group internal rotation dynamics: Overtone study of gaseous methylpyridine-2-alpha d(2) and-3-alpha d(2)
JOURNAL OF PHYSICAL CHEMISTRY A
Mechanistic study of CO2 photoreduction in Ti silicalite molecular sieve by FT-IR spectroscopy
JOURNAL OF PHYSICAL CHEMISTRY A
Thermal properties of poly(ester-imide)s with C12H24 and C22H44 groups
JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS
Singularities in the Hamiltonian at electronic degeneracies
CHEMICAL PHYSICS
Ab initio study of structures of hydrogen-bonded nitric acid complexes
CHEMICAL PHYSICS
Quantum chemical study of structures and vibrational spectra on silicon-sulfur Clusters(SiS2)(n)(-) (n=1-5)
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
Quantum chemical study of silicon-sulfur clusters(SiS2)(n)(+)(n=1-3)
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
Solid-state synthesis and characterization of new layered tellurites of antimony(V), ASb(3)Te(2)O(12) (A = Cs, Rb, Tl)
MATERIALS RESEARCH BULLETIN
Comparative study of the metal-ligand bond strength in Mn-II/X/U complexes(X = Cl, Br, I; U = urea)
JOURNAL OF MOLECULAR STRUCTURE
The low frequency vibrations of hydrogen bonded adipic acid crystals
JOURNAL OF MOLECULAR STRUCTURE
Rotational and vibrational spectra of chloryl fluoride, FClO2: nuclear quadrupole, spin-rotation, and shielding tensors and the harmonic force field
JOURNAL OF MOLECULAR STRUCTURE
High order finite difference algorithms for solving the Schrodinger equation in molecular dynamics. II. Periodic variables
JOURNAL OF CHEMICAL PHYSICS
A theoretical investigation of the temperature dependence of the optical Kerr effect and Raman spectroscopy of liquid CS2
JOURNAL OF CHEMICAL PHYSICS
Theoretical study of XONO2 (X=Br, OBr, O2Br): Implications for stratospheric bromine chemistry
JOURNAL OF CHEMICAL PHYSICS
Fermi resonance coupling in a surface adsorbate: The C-H stretch in methoxy adsorbed on Cu(100) calculations and experiments
JOURNAL OF CHEMICAL PHYSICS
Geometric phase effect in isotopomers of X-3 systems: Use of a split basistechnique for the cone states of HD2
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
Absorption and resonance emission spectra of SO2((X)over-tilde(1)A(1)/(C)over-tilde(1)B(2)) calculated from ab initio potential energy and transitiondipole moment surfaces
CHEMICAL PHYSICS LETTERS
A combined experimental and theoretical study of resonance emission spectra of SO2((C)over-tildeB(2))
CHEMICAL PHYSICS LETTERS
Trends in M(CN) isomerism: A computational study of monocyanides of the main-group third row atoms
PCCP PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Acetylacetonate (acac) anion in the gas phase: predicted structures, vibrational spectra, and photodetachment energies
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY
Ab initio and high resolution infrared study of FC CBr
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
A theoretical study of the re-vibrational spectrum of the X state of CH3
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
Raman and infrared reflectance spectra study of CsLiB6O10
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
Vibrational spectroscopy of complex compounds of gold pentafluoride
RUSSIAN CHEMICAL BULLETIN
Algebraic approach to stretching vibrational spectrum of H2S
CHINESE SCIENCE BULLETIN
High resolution FTIR spectrum of chlorofluoroethyne, FCCCl, below 1000 cm(-1). Analysis of the nu(3), nu(4), nu(5), 2 nu(4), nu(4)+nu(5) and 2 nu(5) bands, and ab initio calculations
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES
The charge transfer mechanism in the SERS of 2-methylpyrazine on silver electrode
VIBRATIONAL SPECTROSCOPY
Phonons and fractons in the vibration spectrum of the relaxor ferroelectric PbMg1/3Nb2/3O3
PHYSICA B
Neutron scattering investigation of ice under hydrostatic helium pressure
HIGH PRESSURE RESEARCH
Heat capacity of solid-state biopolymers by thermal analysis
JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS
Infrared and Raman spectra of (Hg-2)(3)(ASO(4))(2) and Hg-3(AsO4)(2)
JOURNAL OF RAMAN SPECTROSCOPY
Reactive intermediates in the room temperature rhodopsin photo-reactions: Picosecond time-resolved cars
LASER CHEMISTRY
The infrared spectrum of alpha-(NH4)(2)(VO)(3)(P2O7)(2)
JOURNAL OF MATERIALS SCIENCE LETTERS
The vibrational spectrum of methane in an extended boson-realization model
COMMUNICATIONS IN THEORETICAL PHYSICS
Theoretical studies on the structure and vibrational spectrum of N@C-60
CHEMICAL JOURNAL OF CHINESE UNIVERSITIES-CHINESE
Vibrational spectra of nucleic acid bases and their Watson-Crick pair complexes
JOURNAL OF COMPUTATIONAL CHEMISTRY
Ab initio HF and density-functional theory studies on the structure and vibrational frequency of huperzine A
THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE
Computational studies of the structure and vibrational spectra of hexafluorodisilane
THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE
The high-resolution FTIR far-infrared spectrum of formamide
JOURNAL OF MOLECULAR SPECTROSCOPY
TEMPERATURE-DEPENDENT AND FREQUENCY-DEPENDENT OPTICAL-CONSTANTS FOR NITRIC-ACID DIHYDRATE FROM AEROSOL SPECTROSCOPY
The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
BIS(CHLOROMETHYLSILYL)AMINE AND BIS(CHLOROMETHYLSILYL)METHYLAMINE - PREPARATION, REACTIVITY AND SPECTROSCOPIC STUDIES OF THEIR STEREOISOMERS AND CONFORMERS
Journal of the Chemical Society. Dalton transactions
SYNTHESIS AND CHARACTERIZATION OF NEW VANADATES OF ANTIMONY, ASBV(2)O(8) (A = K, RB, TL OR CS)
Journal of the Chemical Society. Dalton transactions
ALGEBRAIC MODEL APPLIED TO VIBRATIONS IN THE ELECTRONIC GROUND-STATE OF NO2
Communications in Theoretical Physics
AN AB-INITIO POTENTIAL-ENERGY SURFACE AND SPECTROSCOPIC CONSTANTS FORTHE X-1-SIGMA(+)(G) STATE OF NO2+
Journal of molecular structure. Theochem
AB-INITIO AND DENSITY-FUNCTIONAL THEORY CALCULATIONS OF THE DIPOLE POLARIZABILITIES OF ETHENE, BENZENE AND NAPHTHALENE
Journal of molecular structure. Theochem
CRYSTAL-STRUCTURE, VIBRATIONAL-SPECTRUM, AND NORMAL-COORDINATE ANALYSIS OF (PNP)(2)[REFBR5]CENTER-DOT-H2O
Zeitschrift fur anorganische und allgemeine Chemie
STUDY OF THE GEOMETRICAL STRUCTURE AND THE VIBRATIONAL-SPECTRA OF P4O8, P4O6S2, AND P4O6SE2
Zeitschrift fur anorganische und allgemeine Chemie
TETRARUBIDIUM NONAGERMANIDE(4-) ETHYLENEDIAMINE, RB-4[GE-9][EN]
Zeitschrift fur anorganische und allgemeine Chemie
PREPARATION AND SPECTROSCOPIC CHARACTERIZATION OF PERFLUORO(ISOPROPYL)-TRIFLUOROACETYLPEROXIDE (CF3)(2)C(F)OOC(O)CF3
Zeitschrift fur anorganische und allgemeine Chemie
GROWTH AND CHARACTERIZATION OF BENZYLIC AMIDE [2]CATENANE THIN-FILMS
Thin solid films
Electronic and vibrational properties of the C-60 molecule
REVISTA MEXICANA DE FISICA
DENSITY OF SI-H BONDS RESPONSIBLE FOR STRUCTURAL FLEXIBILITY IN A-SI-H
Journal of non-crystalline solids
EMPIRICAL FORCE-FIELD OF TRIBROMOETHYL MOLECULES
Journal of molecular structure
THEORETICAL DENSITY-FUNCTIONAL AND AB-INITIO COMPUTATIONAL STUDY OF THE TAUTOMERIC, VIBRATIONAL AND H-BOND PROPERTIES OF 1,7-DI-CH3-GUANINE- A COMPARISON WITH FT-IR DATA FROM MATRIX-ISOLATION EXPERIMENTS
Journal of molecular structure
RAMAN-SPECTRA OF POLYCYCLIC AROMATIC-HYDROCARBONS - COMPARISON OF CALCULATED RAMAN INTENSITY DISTRIBUTIONS WITH OBSERVED SPECTRA FOR NAPHTHALENE, ANTHRACENE, PYRENE, AND PERYLENE
Journal of molecular structure
THE LOW-LYING SINGLET-TRIPLET TRANSITIONS OF PHENYLACETYLENE AND STYRENE - ANALYSIS OF THE VIBRONIC STRUCTURE
Berichte der Bunsengesellschaft fur Physikalische Chemie
THE GAS-PHASE INFRARED-SPECTRA OF PHENANTHRENE-H(10) AND PHENANTHRENE-D(10)
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
THE VIBRATIONAL-SPECTRUM OF ACENAPHTHYLENE - LINEAR DICHROISM AND AB-INITIO MODEL-CALCULATIONS
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
EFFECT OF SURFACE RELAXATION AND RUMPLING ON THE VIBRATIONAL-SPECTRUMOF NO ADSORBED ON A CU2O SURFACE
Journal of molecular catalysis. A, Chemical
THE PEROXY RADICAL AS HYDROGEN-BOND DONOR AND HYDROGEN-BOND ACCEPTOR - A MATRIX-ISOLATION STUDY
The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
INFRARED MATRIX-ISOLATION AND THEORETICAL-STUDIES ON GLUTARIMIDE
The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
THEORETICAL-STUDIES OF XONO2-H2O (X=CL, H) COMPLEXES
The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory
STRETCHING VIBRATIONS AND STRUCTURE OF (HF)(N) (N=4-8) CLUSTERS
Russian chemical bulletin
THE USE OF THE HYBRID DENSITY-FUNCTIONAL THEORY (DFT) APPROACH FOR CALCULATION OF VIBRATIONAL-SPECTRA - NITROMETHANE
Russian chemical bulletin
AB-INITIO STUDY OF THE JAHN-TELLER EFFECT IN MNF3
Zeitschrift für physikalische Chemie
HEAT-CAPACITY OF SOLID-STATE PROTEINS .1. THERMAL-ANALYSIS
Journal of thermal analysis
AB-INITIO CALCULATION STUDY ON VIBRATIONA L-SPECTRA OF BIS(C-P-CARBORANYL) (C2B10H11)(2)
Gaodeng xuexiao huaxue xuebao
HYDROGEN-CYANIDE - THEORY AND EXPERIMENT
Journal of molecular structure. Theochem
AB-INITIO CALCULATIONS OF THE STRUCTURAL, ENERGETIC AND VIBRATIONAL PROPERTIES OF SOME HYDROGEN-BONDED AND VAN-DER-WAALS DIMERS .3. THE FORMALDEHYDE DIMER
Journal of molecular structure. Theochem
PREPARATION OF TETRAMETHYLAMMONIUM BISTRI FLUORMETHOXYBROMATE(I) (CH3)(4)N-)(BR(CF3O)(2)()
Zeitschrift fur anorganische und allgemeine Chemie
TERNARY NITRIDOBORATES .1. LIMG[BN2] AND BA-4[BN2]O-2, COMPOUNDS WITHTHE ANION [N-B-N](3-) - SYNTHESES, CRYSTAL-STRUCTURES, AND VIBRATIONAL-SPECTRA
Zeitschrift fur anorganische und allgemeine Chemie
MODEL ATOM APPROXIMATION FOR ESTIMATING THE LOCALIZED BOND-ENERGY BASED ON THE MORSE POTENTIAL
Journal of structural chemistry
THEORETICAL-ANALYSIS OF THE VIBRONIC STRUCTURE OF THE ZERO-KINETIC-ENERGY PHOTOELECTRON-SPECTRA FROM SINGLE VIBRONIC LEVELS OF THE S-1-STATE MANIFOLD OF NAPHTHALENE
The Journal of chemical physics
PALLADIUM CHEMISTRY IN MOLTEN ALKALI-METAL POLYCHALCOPHOSPHATE FLUXES- SYNTHESIS AND CHARACTERIZATION OF K4PD(PS4)(2), CS4PD(PS4)(2), CS10PD(PSE4)(4), KPDPS4, K2PDP2S6, AND CS2PDP2SE6
Inorganic chemistry
CHEMISTRY OF GOLD IN MOLTEN ALKALI-METAL POLYCHALCOPHOSPHATE FLUXES -SYNTHESIS AND CHARACTERIZATION OF THE LOW-DIMENSIONAL COMPOUNDS A(3)AUP(2)SE(8) (A=K, RB, CS), A(2)AU(2)P(2)SE(6) (A=K, RB), A(2)AUPS(4) (A=K, RH, CS), AND AAUP(2)S(7) (A=K, RB)
Inorganic chemistry