The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors (Unknown)
National licence
- New search for: Boys, S.F.
- New search for: Bernardi, F.
- New search for: Boys, S.F.
- New search for: Bernardi, F.
In:
Molecular Physics
;
19
, 4
;
553-566
;
1970
- Article (Journal) / Electronic Resource
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Title:The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errors
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Contributors:Boys, S.F. ( author ) / Bernardi, F. ( author )
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Published in:Molecular Physics ; 19, 4 ; 553-566
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Publisher:
- New search for: Taylor & Francis Group
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Publication date:1970-10-01
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Size:14 pages
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ISSN:
-
DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:Unknown
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Source:
Table of contents – Volume 19, Issue 4
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.
- 433
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The molecular hamiltonianHoward, B.J. / Moss, R.E. et al. | 1970
- 451
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Thermal averages in molecular physics by operator methodsWitschel, W. et al. | 1970
- 465
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The vibration-rotation hamiltonian of linear moleculesWatson, James K.G. et al. | 1970
- 489
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The anisotropic pseudo-potential for nematic liquid crystalsJames, P.G. / Luckhurst, G.R. et al. | 1970
- 501
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Reactive scattering with activation energy: An empirical modelGrice, R. et al. | 1970
- 513
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Charge overlap effects dependence on the nature of the interaction†Kreek, H. / Pan, Y.H. / Meath, William J. et al. | 1970
- 521
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The dependence of exchange energy on orbital overlapMurrell, J.N. / Teixeira-Dias, J.J.C. et al. | 1970
- 533
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Calculation of the intensities of the vibrational components of the ammonia ultra-violet absorption bandsDurmaz, S. / Murrell, J.N. / Taylor, J.M. / Suffolk, R. et al. | 1970
- 543
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Evidence of restricted rotation in the phenyl thiaxanthyl radicalLunazzi, L. / Mangini, A. / Placucci, G. / Vincenzi, C. / Degani, I. et al. | 1970
- 553
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The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errorsBoys, S.F. / Bernardi, F. et al. | 1970
- 567
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Isotope effects in the Lyman and Werner systems of molecular hydrogenAllison, A.C. / Dalgarno, A. et al. | 1970
- 573
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H-H and C-H coupling constants in neutral and protonated azinesGil, V.M.S. / Pinto, A.J.L. et al. | 1970
- 577
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On the methylene hyperfine splitting in the anion radicals of 1,2-indandione, 4,4-dimethyl-1,2-tetralindione, and fluoreneStrom, E. Thomas / Janzen, Edward G. / Gerlock, John L. et al. | 1970
- 581
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Radical cations of bivalent sulphur heterocyclesChambers, J.Q. / Canfield, N.D. / Williams, D.R. / Coffen, D.L. et al. | 1970
- 585
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Electron spin resonance spectrum of imidazo p-benzoquinone anion: a possible case of proton jumpNair, M.K.V. / Santhanam, K.S.V. / Venkataraman, B. et al. | 1970
- 589
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Low frequency neutron spectrum of 1,3,5-triamino-2,4,6-trinitrobenzeneGupta, V.D. / Deopura, B.L. et al. | 1970