Analysis of magnesium-carbon bonding in magnesium anthracene systems (English)
- New search for: Stegmann, R.
- New search for: Frenking, G.
- New search for: Stegmann, R.
- New search for: Frenking, G.
In:
CANADIAN JOURNAL OF CHEMISTRY
;
74
, 6
;
801-809
;
1996
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ISSN:
- Article (Journal) / Print
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Title:Analysis of magnesium-carbon bonding in magnesium anthracene systems
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Contributors:Stegmann, R. ( author ) / Frenking, G. ( author )
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Published in:CANADIAN JOURNAL OF CHEMISTRY ; 74, 6 ; 801-809
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Publisher:
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Publication date:1996-01-01
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Size:9 pages
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ISSN:
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Type of media:Article (Journal)
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Type of material:Print
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Language:English
- New search for: 540
- Further information on Dewey Decimal Classification
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Classification:
DDC: 540 -
Source:
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Table of contents – Volume 74, Issue 6
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 775
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Kinetic energy analysis of atomic multiplets. II. smdn configurationsKoga, Toshikatsu et al. | 1996
- 775
-
Kinetic energy analysis of atomic multiplets. II. s^ma^m configurationsKoga, T. / Aoki, H. / Thakkar, A. J. et al. | 1996
- 781
-
Dispersion formulas for real- and imaginary-frequency-dependent hyperpolarizabilitiesBishop, David M. et al. | 1996
- 786
-
Topological properties of the electronic structures of the reactants, transition states, and products of the reactions of the hydroxyl radical with the series C2HnF6-n, nMartell, Jaime M. et al. | 1996
- 786
-
Topological properties of the electronic structures of the reactants, transition states, and products of the reactions of the hydroxyl radical with the series C~2H~nF~6~-~n, n = 1-6Martell, J. M. / Tee, J. B. / Boyd, R. J. et al. | 1996
- 801
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Analysis of magnesium-carbon bonding in magnesium anthracene systemsStegmann, Ralf et al. | 1996
- 810
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The 1,2,3,5-ditelluradiazolyl (HCN2Te2) species. Theoretical characterizations of the cation, radical, and radical dimersDavis, William M. et al. | 1996
- 819
-
A unified approach to dynamic NMR based on a physical interpretation of the transition probabilityBain, Alex D. et al. | 1996
- 825
-
Non-additivity of intermolecular forces in helium and beryllium clustersNovaro, O. et al. | 1996
- 829
-
On the differential geometry of interatomic surfacesPopelier, Paul L.A. et al. | 1996
- 839
-
Theoretical examination of the Diels-Alder reaction of 1,3-butadiene with cyclopentadiene and 2H-phospholeBachrach, Steven M. et al. | 1996
- 851
-
Inner-shell excitation spectroscopy of aniline, nitrobenzene, and nitroanilinesTurci, Cássia C. et al. | 1996
- 870
-
Cohesive properties of metals as determined from atomic charge densitiesTal, Yoram et al. | 1996
- 875
-
Applications and evaluation of IGAIM 13C and 1H chemical shift calculations for unsaturated hydrocarbons and organolithium compoundsWerstiuk, Nick Henry et al. | 1996
- 885
-
Some results on the electrostatic energy of ionic crystalsEssén, Hanno et al. | 1996
- 892
-
The role of hydrogens in stabilizing organic ionsWiberg, Kenneth B. et al. | 1996
- 901
-
The theory of atoms in molecules as a tool to investigate the reactivity of tetraphosphacubaneMo, O. et al. | 1996
- 910
-
An ab initio study on the insertion reactions of CH (X2P) with NH3, H2O, and HFWang, Zhi-Xiang et al. | 1996
- 918
-
Calculation of static molecular properties in the framework of the unitary group based coupled cluster approachPaldus, Josef et al. | 1996
- 931
-
Solvent isotope effects as a probe of general catalysis and solvation in phosphoryl transferBryan, Clinton D. et al. | 1996
- 939
-
Orthogonal effective atomic orbitals in the topological theory of atomsMayer, I. et al. | 1996
- 943
-
Electrostatic properties of ammonium fluoride and deuterated ice-IhBeek, C.G.van et al. | 1996
- 951
-
Cyclobutene photochemistry. Adiabatic photochemical ring opening of alkylcyclobutenesLeigh, William J. et al. | 1996
- 965
-
On the stability of endohedral rare gas fullerenesClougherty, Dennis P. et al. | 1996
- 969
-
Local energy and chemical potential equations and the exchange-correlation potentialMarch, N.H. et al. | 1996
- 976
-
Topologically partitioned dynamic polarizabilities using the theory of atoms in moleculesHättig, Christof et al. | 1996
- 988
-
Coherent control of electrons in moleculesBandrauk, Andre D. et al. | 1996
- 995
-
Current-density dependent exchange-correlation functionalsBecke, Axel D. et al. | 1996
- 998
-
Strongly bound doubly excited states of Be2Bruna, Pablo J. et al. | 1996
- 1005
-
Density-functional calculation of core-electron binding energies of glycine conformersChong, Delano P. et al. | 1996
- 1008
-
Atoms in molecules from the exact one-electron wave functionHunter, Geoffrey et al. | 1996
- 1014
-
Study of NO and CO dissociation on the (100) Cu surface using density functional theory and the topological analysis of the electronic density and its LaplacianAray, Yosslen et al. | 1996
- 1021
-
Delocalized bonding in tetrahedral organo-transition metal clusters: An EHMO study of metal vertex rotations in Co2Fe(CO)9S, CpMoCo2(CO)8CR, and in Cp2Mo2(CO) 4)(RC(equivalent)CR)Malisza, Krisztina L. et al. | 1996
- 1032
-
On the accuracy of density functional theory for ion-molecule clusters. A case study of PLn+ clusters of the first and second row hydridesLopez, Xabier et al. | 1996
- 1049
-
Molecular charge density analysisHinze, Juergen et al. | 1996
- 1054
-
Charge density study with the Maximum Entropy Method on model data of silicon. A search for non-nuclear attractorsVries, R.Y.de et al. | 1996
- 1059
-
Topological studies of the charge density of some group 2 metallocenes M(h5-C5H5)2(MBytheway, Ian et al. | 1996
- 1072
-
A comparative study of the energetics, structures, and mechanisms of the HCN <-> HNC and LiCN <-> LiNC isomerizationsRao, V.Sreedhara et al. | 1996
- 1078
-
Proton and electron transfers in O.H.O and C.H.O hydrogen-bridged ions: Their role in the dissociation chemistry of ionized acetol, CH3C(=O)CH2OH-+Ruttink, Paul J.A. et al. | 1996
- 1088
-
Topological analysis of the electron localization function applied to delocalized bondsSavin, A. et al. | 1996
- 1097
-
Approximate kinetic energy density functionals generated by local-scaling transformationsLudeña, E.V. et al. | 1996
- 1106
-
Zero-temperature equation-of-motion of electron pair in the BCS theory of superconductivityTachibana, Akitomo et al. | 1996
- 1116
-
The topology of the valence shell and the electric field gradient at the nitrogen nucleus in aziridinesRosillo, Félix et al. | 1996
- 1121
-
Quantum chemical valence indices from the one-determinantal difference approachNalewajski, Roman F. et al. | 1996
- 1131
-
Atomic origins of molecular polarizabilitiesLaidig, Keith E. et al. | 1996
- 1139
-
Analysis of molecular polarizabilities and polarizability derivatives in H2, N2, F2, CO, and HF, with the theory of atoms in moleculesGough, Kathleen M. et al. | 1996
- 1145
-
Charge density in crystalline citrinin from X-ray diffraction at 19 KRoversi, Pietro et al. | 1996
- 1162
-
A theoretical study of some X-H...p hydrogen-bonded complexes using the theory of atoms in moleculesTang, Ting-Hua et al. | 1996
- 1171
-
Topological analysis of the experimental electron densityTsirelson, Vladimir G. et al. | 1996
- 1180
-
Anisotropic and isotropic triple-dipole dispersion energy coefficients for all three-body interactions involving He, Ne, Ar, Kr, Xe, H2, N2, and COMcDowell, Sean A.C. et al. | 1996
- 1187
-
Topological analysis of electron momentum densities and the bond directional principle: The first-row hydrides, AH, and homonuclear diatomic molecules, A2Wang, Jiahu et al. | 1996
- 1192
-
Oxidative damage to the glycyl a-carbon site in proteins: An ab initio study of the C-H bond dissociation energy and the reduction potential of the C-centered radicalArmstrong, D.A. et al. | 1996
- 1200
-
Interpretation of neighboring group interactions in crystal structures. A solid state and quantum-chemical study of "incipient nucleophilic attack" in 2-diazonium benzoic acid and its benzoateGlaser, Rainer et al. | 1996
- 1215
-
Origin of depressed dipole moments in five-membered, unsaturated heterocyclesLaidig, Keith E. et al. | 1996
- 1221
-
The anomeric effect in first-row-second-row acetal-like systemsScott, Camilla et al. | 1996
- 1229
-
From topology to geometryEberhart, Mark et al. | 1996
- 1236
-
Molecules in high-intensity laser fieldsNguyen-Dang, T.-T. et al. | 1996
- 1248
-
On the performance of molecular model core potential orbitals in spin-orbit and electron correlation studiesKrause, Dietmar et al. | 1996
- 1253
-
Comparative electronic analysis between hydrogen transfers in the CH4-CH3+, CH4-CH3+, and CH 4)-CH3- systems: On the electronic nature of the hydrogen (H-, H., and H+) being transferredMestres, Jordi et al. | 1996
- 1263
-
Variability of shapes and properties of atoms in molecules: A case study of the carbonyl oxygenStefanov, Boris B. et al. | 1996
- 1271
-
Charge and energy redistribution in sulfonamides undergoing conformational changes. Hybridization as a controlling influence over conformer stabilityBreneman, Curt M. et al. | 1996