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Results 1 to 25 of 8864

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Picometer-scale electronic control of molecular dynamics inside a single moleculeLASTAPIS, M; MARTIN, M; RIEDEL, D et al.Science (Washington, D.C.). 2005, Vol 308, Num 5724, pp 1000-1003, issn 0036-8075, 4 p.Article

Scale-invariant power law and fractality for molecular weightsPAAR, V; PAVIN, N; RUBCIC, A et al.Chemical physics letters. 2001, Vol 336, Num 1-2, pp 129-134, issn 0009-2614Article

Deep inelastic neutron scattering from freely rotating moleculesCOLOGNESI, D; DEGIORGI, E; PACE, E et al.Physica. B, Condensed matter. 2001, Vol 293, Num 3-4, pp 317-332, issn 0921-4526Article

Second-order vibronic reduction factors for orbital triplet Jahn-Teller systems in cubic and icosahedral symmetryBATES, Colin A; ABOU-GHANTOUS, Michel; DUNN, Janette L et al.Journal of physics. Condensed matter (Print). 2004, Vol 16, Num 29, pp 5309-5325, issn 0953-8984, 17 p.Article

Nucleus-independent chemical shifts and local aromaticities in large polycyclic aromatic hydrocarbonsAIHARA, Jun-Ichi.Chemical physics letters. 2002, Vol 365, Num 1-2, pp 34-39, issn 0009-2614, 6 p.Article

Influencing intramolecular motion with an alternating electric fieldBERMUDEZ, V; CAPRON, N; GASE, T et al.Nature (London). 2000, Vol 406, Num 6796, pp 608-611, issn 0028-0836Article

«CONTRIBUTION A L'ETUDE DES EFFETS ELECTRONIQUES DES RESTES 4 OU 5-[1,2-DITHIOLE-3-THIONE]-YL ET 4 OU 5-[1,2-DITHIOLE-3-ONE]-YL» = A STUDY OF THE ELECTRONIC EFFECTS OF 4 OR 5-[1,2-DITHIOLE-3THIONE]-YL AND 4 OR 5-[1,2-DITHIOLE-3-ONE]-YL RESTSCHOLLET, Marylène; BURGOT, Jean-Louis.1997, 224 p.Thesis

High-spin organic polyradicals as simple spin clustersRAJCA, A.Molecular crystals and liquid crystals science and technology. Section A, Molecular crystals and liquid crystals. 1997, Vol 305, pp 567-577, issn 1058-725XConference Paper

Hydrures, hydrogène et coordination de liaisons σ = Hydrides, hydrogen and σ bond coordinationCHAUDRET, B.L' Actualité chimique (Paris. 1973). 1996, Num 7, pp 26-35, issn 0151-9093Conference Paper

Gas-phase acidity of D-glucose. A density functional theory studySALPIN, Jean-Yves; TORTAJADA, Jeanine.Journal of mass spectrometry. 2004, Vol 39, Num 8, pp 930-941, issn 1076-5174, 12 p.Article

Ab initio quantum mechanical calculations of energy, geometry, vibrational frequencies and IR intensities of tetraphosphorus tetrasulphide, a-P4S4(D2d), and vibrational analysis of As4S4 and As4Se4YSTENES, M; MENZEL, F; BROCKNER, W et al.Spectrochimica acta. Part A : Molecular spectroscopy. 1994, Vol 50, Num 2, pp 225-231, issn 0584-8539Article

An analytical approach to obtaining a valid solution to the secular equations for cis-disubstituted octahedral metal carbonylsKAYA, C.Spectrochimica acta. Part A : Molecular spectroscopy. 1994, Vol 50, Num 6, pp 1101-1105, issn 0584-8539Article

Ab initio calculation of the geometry and vibrational frequencies of the isoelectronic tetrahedral species XClε4 and SXε4 (X=Ne-Ar) with extended and minimal basis setsYSTENES, M; EHRHARDT, B. K.Journal of molecular structure. Theochem. 1994, Vol 303, pp 155-162, issn 0166-1280Article

Molecular bistability and chaosJIAN-MIN YUAN; LIE, G. C.Advances in chemical physics. 1994, Vol 85, pp 1-53, issn 0065-2385, 3Article

Regularized force fields of molecules based on ab initio quantum chemical calculationsKURAMSHINA, G. M; WEINHOLD, F; KOCHIKOV, I. V et al.Russian journal of physical chemistry. 1994, Vol 68, Num 3, pp 358-370, issn 0036-0244Article

Superparameterization of low-temperature vibrational data for lanthanide hexahalide anionsTANNER, P; SHEN, M.-Y.Spectrochimica acta. Part A : Molecular spectroscopy. 1994, Vol 50, Num 5, pp 997-1003, issn 0584-8539Article

An application of minimax robust optimal control theory for selective vibrational excitation in moleculesBEUMEE, J. G. B; RABITZ, H.Journal of mathematical chemistry. 1993, Vol 14, Num 3-4, pp 405-425, issn 0259-9791Article

An ab initio correlated computation of vibrations in the ClONO2 moleculeSLANINA, Z.Spectroscopy letters. 1993, Vol 26, Num 10, pp 1965-1973, issn 0038-7010Article

Quasi-action variable for chaos in chemical dynamicsTAKATSUKA, K.Bulletin of the Chemical Society of Japan. 1993, Vol 66, Num 11, pp 3189-3202, issn 0009-2673Article

WKB approximation for the rotating Morse oscillatorVARSHNI, Y. P.Canadian journal of physics (Print). 1993, Vol 71, Num 3-4, pp 122-127, issn 0008-4204Article

The vibrational frequencies of borane (BH3) : a comparison of high level theoretical resultsGALBRAITH, J. M; VACEK, G; SCHAEFER, H. F et al.Journal of molecular structure. 1993, Vol 300, pp 281-288, issn 0022-2860Article

Theoretical far-infrared spectra of CO in Ar gasROCO, J. M. M; MEDINA, A; CALVO HERNANDEZ, A et al.Chemical physics letters. 1993, Vol 216, Num 3-6, pp 593-598, issn 0009-2614Article

Topology and dynamics of vibronically coupled potential energy surfaces : general aspects and application to the ozone cationMÜLLER, H; KÖPPEL, H; CEDERBAUM, L. S et al.New journal of chemistry (1987). 1993, Vol 17, Num 1-2, pp 7-29, issn 1144-0546Article

Mass spectrometric determination of the dissociation energy of the AuMg diatomic moleculeBALDUCCI, G; CICCIOLI, A; GIGLI, G et al.Chemical physics letters. 2003, Vol 369, Num 3-4, pp 449-453, issn 0009-2614, 5 p.Article

A test of an adiabatic treatment of rotation for vibration/rotation energies of polyatomic moleculesBOWMAN, J. M.Chemical physics letters. 1994, Vol 217, Num 1-2, pp 36-40, issn 0009-2614Article

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