Relativistic one-electron Hamiltonians 'for electrons only' and the variational treatment of the Dirac equation (Unknown)
- New search for: Kutzelnigg, W.
- New search for: Kutzelnigg, W.
In:
Chemical physics
;
225
, 1-3
; 203-222
;
1997
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ISSN:
- Article (Journal) / Print
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Title:Relativistic one-electron Hamiltonians 'for electrons only' and the variational treatment of the Dirac equation
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Contributors:Kutzelnigg, W. ( author )
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Published in:Chemical physics ; 225, 1-3 ; 203-222
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Publisher:
- New search for: Elsevier
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Place of publication:Amsterdam [u.a.]
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Publication date:1997
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ISSN:
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ZDBID:
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Type of media:Article (Journal)
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Type of material:Print
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Language:Unknown
- New search for: 35.00 / 35.10
- Further information on Basic classification
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Table of contents – Volume 225, Issue 1-3
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.
- 1
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Stability, properties and electronic g-tensors of H2CO- as stabilized in H2CO . Na complexesBruna, P.J. et al. | 1997
- 17
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First observation of ro-vibrational transitions of the SiC radical by infrared LMR spectroscopyWienkoop, M. et al. | 1997
- 23
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An ab initio study on the four electronically lowest-lying states of CH2 using the state-averaged complete active space second-order configuration interaction methodYamaguchi, Y. et al. | 1997
- 33
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A theoretical calculation of the absorption spectrum of CH+-2Osmann, G. et al. | 1997
- 55
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Ab initio study of NO2. VII. A2B2 <-- X2A1 nonadiabatic Franck-Condon absorption spectrumBrandi, R. et al. | 1997
- 63
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Ab initio treatment of the Renner-Teller effect in tetra-atomic molecules undergoing large amplitude bending vibrationsPeric, M. et al. | 1997
- 77
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The rQ1 branch of carbodiimide, HNCNH, at 1.1 THzJabs, W. et al. | 1997
- 93
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Multiple surface intersections and strong nonadiabatic coupling effects between the D2E1u and E2B2U states of C6H+-6Döscher, M. et al. | 1997
- 107
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Excited vibrational states of benzene: High resolution FTIR spectra and analysis of some out-of-plane vibrational fundamentals of C6H5DSnels, M. et al. | 1997
- 131
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Coupled cluster calculations for three low-lying doublet states of linear C--10Botschwina, P. et al. | 1997
- 139
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The lowest valence transitions of 1,1'-bicyclohexylidene and 1,1';4,1'-tercyclohexylidene. An ab initio MRDCI studyHavenith, R.W.A. et al. | 1997
- 153
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Singlet and triplet excited states of a pyramidalized alkene: Electron-energy-loss spectra, photoelectron spectra, and calculations of the excited states of tricyclo(3.3.3.03.7)undec-3(7)-eneBulliard, C. et al. | 1997
- 163
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Geometries and interconversion pathways of free and protonated b-ionone Schiff bases. An ab initio study of photoreceptor chromophore model compoundsTerstegen, F. et al. | 1997
- 163
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Geometries and interconversion pathways of free and protonated -ionone Schiff bases. An ab initio study of photoreceptor chromophore model compoundsTerstegen, F. / Buss, V. et al. | 1997
- 173
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Ab-initio study of optical response properties of nonstoichiometric lithium-hydride and sodium-fluoride clustersBonacic-Koutecky, V. et al. | 1997
- 189
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Photodissociation of methane on platinumWhitten, J.L. et al. | 1997
- 197
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New algorithms for an individually selecting MR-CI programHanrath, M. et al. | 1997
- 203
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Relativistic one-electron Hamiltonians 'for electrons only' and the variational treatment of the Dirac equationKutzelnigg, W. et al. | 1997
- 223
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An extrapolation scheme for spin-orbit configuration interaction energies applied to the ground and excited electronic states of thallium hydrideRakowitz, F. et al. | 1997
- 239
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The use of Gaussian spinors in relativistic electronic structure calculations: The effect of the boundary of the finite nucleus of uniform proton charge distributionIshikawa, Y. et al. | 1997
- 247
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Relativistic configuration interaction calculations of the potential curves and radiative lifetimes of the low-lying states of bismuth nitrideAlekseyev, A.B. et al. | 1997
- 259
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Resonances in the photodissociation of CO2: Periodic-orbit and wavepacket analysesBurghardt, I. et al. | 1997
- 299
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Ultrafast excitation process in NaNH3: A combined theoretical and experimental analysisVivie-Riedle, R.de et al. | 1997
- 309
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Calculation of total photoabsorption cross sections of Ar, Kr, N2 and COStein, N. et al. | 1997
- 319
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Author index| 1997
- 323
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Subject index| 1997
- 331
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Instructions to authors| 1997