Si mostrano 100 riferimenti a partire da 1 |
Per ulteriori informazioni selezionare i riferimenti di interesse.
Theoretical study of the Si-H group as potential hydrogen bond donor
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
The microwave spectra and structure of the complex 7-oxabicyclo[2.2.1]heptane center dot center dot center dot HF
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Isotope effects in X-H center dot center dot center dot pi type hydrogen-bonded complexes (X = F, Cl or Br)
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Microwave Fourier transform spectroscopy of vinylstibine
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
The axial and equatorial hydrogen bonds in the tetrahydropyran center dot center dot center dot HF complex
CHEMPHYSCHEM
The Cologne Database for Molecular Spectroscopy, CDMS
ASTRONOMY & ASTROPHYSICS
An ab-initio study of the C3H6-HX, C2H4-HX and C2H2-HX hydrogen-bonded complexes with X=F or CI
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
General discussion
FARADAY DISCUSSIONS
Water and its homologues: a comparison of hydrogen-bonding phenomena
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
Enhanced stability of non-proton-transferred clusters of hydrated hydrogenfluoride HF(H2O)(n) (n=1-7): A molecular orbital study
JOURNAL OF PHYSICAL CHEMISTRY A
Ab initio and cryospectroscopic investigation of the Van der Waals complexes of methyleyclopropane with hydrogen chloride and boron trifluoride
JOURNAL OF PHYSICAL CHEMISTRY A
Infrared spectrum of the H3N-HCl complex in solid Ne, Ne/Ar, Ar, and Kr. Matrix effects on a strong hydrogen-bonded complex
JOURNAL OF PHYSICAL CHEMISTRY A
C-H center dot center dot center dot X hydrogen bonds of acetylene, ethylene, and ethane with first- and second-row hydrides
JOURNAL OF PHYSICAL CHEMISTRY A
Intracollisional interference of R lines of HD in mixtures of deuterium hydride and helium gas - art. no. 052514
PHYSICAL REVIEW A
Sub-doppler measurements and terahertz rotational spectrum of C-12(18)-O
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES
Revisiting the Generator Coordinate Approximation for calculating the Ro-vibrational energies of H-3(+)
JOURNAL OF COMPUTATIONAL CHEMISTRY
Reactive ion scattering from pure and mixed HCl, NH3 and D2O surfaces
NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS
Ab initio calculation of the structure and infrared spectra of the van derWaals complex H2O center dot F-2
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Main group metal-ligand interactions in small molecules: new insights fromlaser spectroscopy
INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY
Nonempirical models of complexes with linear H-bonds
RUSSIAN JOURNAL OF PHYSICAL CHEMISTRY
Infrared spectroscopy of van der Waals modes in the intermolecular potential of Ar-CO: The K-a=0 combination of stretch and bending
MOLECULAR PHYSICS
Observation of a high lying van der Waals mode in the intermolecular potential of Ar-CO
MOLECULAR PHYSICS
Microwave spectra and structure of an isoxazole-water complex
MOLECULAR PHYSICS
An ab initio study of the structural and vibrational properties of the C3H6-HCN, C2H4-HCN and C2H2-HCN hydrogen-bonded complexes
JOURNAL OF MOLECULAR STRUCTURE
Diode laser jet spectra and analysis of the nu(3) and nu(8) fundamentals of CHF2Cl
JOURNAL OF MOLECULAR SPECTROSCOPY
Millimeter- and submillimeter-wave spectra of CuF and AgF in the X-1 Sigma+ electronic ground states
JOURNAL OF MOLECULAR SPECTROSCOPY
The gas-phase electric dipole moments of the symmetric top tertiary butyl molecules (BuX)-Bu-t, X = F, Cl, Br, I, CN, and NC
JOURNAL OF MOLECULAR SPECTROSCOPY
Experimental and ab initio equilibrium structure and harmonic force field of 1,2,5-oxadiazole
JOURNAL OF MOLECULAR SPECTROSCOPY
Microwave spectrum, structure, and hyperfine constants of Kr-AgCl: Formation of a weak Kr-Ag covalent bond
JOURNAL OF MOLECULAR SPECTROSCOPY
Vibrational spectra, DFT calculations, and assignments of the syn and the gauche forms of vinylphosphine
JOURNAL OF MOLECULAR SPECTROSCOPY
Diode-laser jet spectra and analysis of the nu(1) and nu(4) fundamentals of CCl3F
JOURNAL OF MOLECULAR SPECTROSCOPY
Hydrogen bonding in benzonitrile-water complexes
JOURNAL OF CHEMICAL PHYSICS
Relative stabilities of H- and D-bonded isotopomers of HCN center dot center dot center dot HF and HNC center dot center dot center dot HF
JOURNAL OF CHEMICAL PHYSICS
Fourier transform microwave spectroscopy of the (2)Sigma(+) ground states of YbX (X=F, Cl, Br): Characterization of hyperfine effects and determination of the molecular geometries
JOURNAL OF CHEMICAL PHYSICS
The permanent electric dipole moment of MgNC
JOURNAL OF CHEMICAL PHYSICS
The rovibrational structure of the Ar-CO complex from a model interaction potential
JOURNAL OF CHEMICAL PHYSICS
Hydrogen bond radii for the hydrogen halides and van der Waals radius of hydrogen
JOURNAL OF CHEMICAL PHYSICS
Observation of the FeNC molecule by laser fluorescence excitation spectroscopy
JOURNAL OF CHEMICAL PHYSICS
Internal dynamics in azetidine: A microwave and ab initio study
JOURNAL OF CHEMICAL PHYSICS
Formation of ammonium halide particles from pure ammonia and hydrogen halide gases: A theoretical study on small molecular clusters (NH3-HX)(n) (n=1,2, 4; X = F, Cl, Br)
JOURNAL OF CHEMICAL PHYSICS
HF inversion in the 2,5-dihydrofuran center dot center dot center dot HF complex
JOURNAL OF CHEMICAL PHYSICS
Intermolecular bending levels in an open-shell diatom-diatom complex: Infrared spectroscopy and model calculations of the OH-N-2 complex
JOURNAL OF CHEMICAL PHYSICS
Activation of the CH stretching vibrations in CH4-OH entrance channel complexes: Spectroscopy and dynamics
JOURNAL OF CHEMICAL PHYSICS
High-level ab initio predictions of CO2 center dot center dot center dot N2O structure
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
Microwave spectra, geometries, and hyperfine constants of OCCuX (X = F, Cl, Br)
INORGANIC CHEMISTRY
The millimeter/sub-millimeter spectrum of the LiS radical in its (2)Pi(i) ground state
CHEMICAL PHYSICS LETTERS
High-sensitivity infrared-microwave-microwave triple-resonance spectroscopy of isomerizing molecules
CHEMICAL PHYSICS LETTERS
Trends in the alkaline-earth amide series: The millimetre-wave spectrum ofMgNH2 and MgND2 ((X)over-tilde(2)A(1))
CANADIAN JOURNAL OF PHYSICS
The Cl-O bond in chlorine oxides: Electronic structure and empirical forceconstants
CANADIAN JOURNAL OF PHYSICS
The deuterium abundance in Jupiter and Saturn from ISO-SWS observations
ASTRONOMY AND ASTROPHYSICS
An investigation of the gas-phase complex of water and iodine monochlorideby microwave spectroscopy: geometry, binding strength and electron redistribution
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Large amplitude motions in the electronic ground state of 4-fluoroaniline
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Computations of medium strength hydrogen bonds-complexes of mono- and bi-functional carbonyl and nitrile compounds with hydrogen chloride
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Noble gas-metal chemical bonding: the microwave spectra, structures and hyperfine constants of Ar-AuF and Ar-AuBr
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
On the HCl and DCl complexes of methylenecyclopropane in liquid argon
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
Spectroscopy of the formaldehyde isotopomer (H2CO)-C-13 in the microwave to terahertz region
PHYSICAL CHEMISTRY CHEMICAL PHYSICS
The acetylene-ammonia dimer as a prototypical C-H center dot center dot center dot N hydrogen-bonded system: An assessment of theoretical procedures
JOURNAL OF PHYSICAL CHEMISTRY A
Neon matrix isolation electron spin resonance and theoretical studies of the various isotopomers of the CH3Mg radical
JOURNAL OF PHYSICAL CHEMISTRY A
Methylenecyclopropane-boron trifluoride van der Waals complexes; an infrared and DFT study
JOURNAL OF PHYSICAL CHEMISTRY A
Charge-transfer complexes between NH3 and the halogens F-2, ClF, and Cl-2:An ab initio study on the intermolecular interaction
JOURNAL OF PHYSICAL CHEMISTRY A
An attempt to systematize the vibrational shifts in CO2 monomers and dimers trapped in various matrices
JOURNAL OF PHYSICAL CHEMISTRY A
Matrix-isolation ESR studies of the various isotopomers of the CH3Zn and ZnH radicals: Comparisons with ab initio theoretical calculations
JOURNAL OF PHYSICAL CHEMISTRY A
Gaussian-2 and Gaussian-3 study of the energetics and structures of Cl2On and Cl2On+, n=1-7
JOURNAL OF PHYSICAL CHEMISTRY A
Anisotropy of atomic van der Waals radii in the gas-phase and condensed molecules
STRUCTURAL CHEMISTRY
Analysis of the HDO absorption spectrum between 9600-10200cm(-1)
CHINESE PHYSICS
Structural and electronic properties of the charge-transfer complex H3P center dot center dot center dot Br-2 determined by Fourier transform microwave spectroscopy
CHEMISTRY-A EUROPEAN JOURNAL
Conformation and stability of the hydrogen-bonded complex 6-oxabicyclo[3.1.0]hexane center dot center dot center dot HCl
CHEMISTRY-A EUROPEAN JOURNAL
Approximate factorization of molecular potential surfaces II. Internal rotors
ZEITSCHRIFT FUR PHYSIKALISCHE CHEMIE-INTERNATIONAL JOURNAL OF RESEARCH IN PHYSICAL CHEMISTRY & CHEMICAL PHYSICS
The submillimeter-wave spectrum of the formaldehyde isotopomer (H2CO)-O-18in its ground vibrational state
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES
Density functional theory and Hartree-Fock-density functional theory calculations of O-17, S-33, and Ge-73 quadrupole coupling constants
CHEMICAL PHYSICS
DFT and HF-DFT calculations of N-14 quadrupole coupling constants in molecules
CHEMICAL PHYSICS
An unusual solvent isotope effect in the reaction of W(CO)(5)(solv) (solv = cyclohexane or cyclohexane-d(12)) with THF
ORGANOMETALLICS
Matrix photochemistry of gallium and indium atoms (M) in the presence of methane: Formation and characterization of the divalent species CH3MH and univalent species CH3M
ORGANOMETALLICS
Ab initio determination of the infrared phosphine torsion spectrum in vinylphosphine with ZPE correction
JOURNAL OF COMPUTATIONAL CHEMISTRY
Rotational spectrum and modeling of the OCS-(HCCH)(2) trimer
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM
Geometrical phase effects in biaxial nanomagnetic particles
PHYSICAL REVIEW B
Resonant tunneling and quenching of tunnel splitting in Wess-Zumino nanospin systems
PHYSICAL REVIEW B
SiC2 in carbon stars: Merrill-Sanford absorption bands between 4100 and 5500 angstrom
MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY
Infrared spectrum of the Ar-CO complex: observation of the (v)co=2 <- 0 band at 4260 cm (-1)
MOLECULAR PHYSICS
The microwave spectrum and quadrupole coupling in tricarbonyl(methylcyclopentadienyl) manganese
MOLECULAR PHYSICS
Microwave spectra and structure of the fluorobenzene-carbon monoxide van der Waals complex
MOLECULAR PHYSICS
HITRAN partition functions and weighted transition-moments squared
JOURNAL OF QUANTITATIVE SPECTROSCOPY & RADIATIVE TRANSFER
A density functional study of the xenon dihydride-water complex
JOURNAL OF MOLECULAR STRUCTURE
Ab initio computations on simple carbonyl compounds
JOURNAL OF MOLECULAR STRUCTURE
A cryospectroscopic and ab initio study of the cyclopropane center dot(HCl)(x) van der Waals complexes
JOURNAL OF MOLECULAR STRUCTURE
Rotational transitions and electric dipole moment of fluorocarbene, HCF
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
Infrared optothermal spectroscopy of N-2- and OC-DCCH: The C-H stretching region
JOURNAL OF MOLECULAR SPECTROSCOPY
Variational evaluation of the HSSHFIR transitions: The anomalous K-doubling
JOURNAL OF MOLECULAR SPECTROSCOPY
The dynamics of N-2-O-3 and N-2-SO2 probed by microwave spectroscopy
JOURNAL OF MOLECULAR SPECTROSCOPY
Pseudorotation in tetrahydrofuran center dot center dot center dot HF heterodimer
JOURNAL OF CHEMICAL PHYSICS
Ultraviolet laser spectroscopy of jet-cooled CaNC and SrNC free radicals: Observation of bent excited electronic states
JOURNAL OF CHEMICAL PHYSICS
Structure of the chlorobenzene-argon dimer: Microwave spectrum and ab initio analysis
JOURNAL OF CHEMICAL PHYSICS
Photoelectron spectroscopy and ab initio study of mixed cluster anions of [(CO2)(1-3)(Pyridine)(1-6)](-): Formation of a covalently bonded anion coreof (C5H5N-CO2)(-)
JOURNAL OF CHEMICAL PHYSICS
A new method of calculation of Franck-Condon factors which includes allowance for anharmonicity and the Duschinsky effect: Simulation of the HeI photoelectron spectrum of ClO2
JOURNAL OF CHEMICAL PHYSICS
Structures of the linear silicon carbides SiC4 and SiC6: Isotopic substitution and Ab Initio theory
JOURNAL OF CHEMICAL PHYSICS
The state-to-state predissociation dynamics of OC-HF upon HF stretch excitation
JOURNAL OF CHEMICAL PHYSICS
Structure and dynamics of N-2-IH
JOURNAL OF CHEMICAL PHYSICS
Vibrationally resolved photoelectron spectra of CuCN- and AgCN- and ab initio studies of the structure and bonding in CuCN
JOURNAL OF CHEMICAL PHYSICS
The microwave spectra and structures of Ar-AgX (X=F,Cl,Br)
JOURNAL OF CHEMICAL PHYSICS