nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Ab initio calculations on the allyl radical
|
Hinchliffe, A. |
|
1971 |
11 |
1 |
p. 131-133 3 p. |
artikel |
2 |
Ab initio calculations on the hydration of monatomic cations. (LCAO MO studies on molecular structure VII)
|
Schuster, P. |
|
1971 |
11 |
1 |
p. 35-37 3 p. |
artikel |
3 |
An empirical intermolecular potential function for solid carbon dioxide
|
Donkersloot, M.C.A. |
|
1971 |
11 |
1 |
p. 105-108 4 p. |
artikel |
4 |
A new interpretation for the structure of the VN bands of ethylene
|
Buenker, R.J. |
|
1971 |
11 |
1 |
p. 65-70 6 p. |
artikel |
5 |
A new method for the calculation of vibrational force constants. Application to H2
|
Shipman, L.L. |
|
1971 |
11 |
1 |
p. 101-104 4 p. |
artikel |
6 |
Angular distribution of photoelectrons from different rotational H2 → H2 + transitions
|
Niehaus, A. |
|
1971 |
11 |
1 |
p. 55-57 3 p. |
artikel |
7 |
A possible explanation for the anomalous low-pressure activation energy for the decomposition of CO2
|
Gilbert, R.G. |
|
1971 |
11 |
1 |
p. 146-148 3 p. |
artikel |
8 |
Asymptotic behaviour of incoherent scattering functions
|
Smith Jr., V.H. |
|
1971 |
11 |
1 |
p. 152- 1 p. |
artikel |
9 |
Brownian-motion contributions to relaxation in nematic liquid crystals
|
Samulski, E.T. |
|
1971 |
11 |
1 |
p. 113-116 4 p. |
artikel |
10 |
Charge densities and bond orders for zero differential overlap wavefunctions: Comparison with ab-initio calculations and diffraction results
|
McIver Jr., J.W. |
|
1971 |
11 |
1 |
p. 82-85 4 p. |
artikel |
11 |
Comments on a small gaussian basis set used in recent work on polymers
|
Cook, D.B. |
|
1971 |
11 |
1 |
p. 97-98 2 p. |
artikel |
12 |
Data correlation and error analysis in electron diffraction studies of gases
|
MacGregor, M.A. |
|
1971 |
11 |
1 |
p. 29-34 6 p. |
artikel |
13 |
Effect of higher excited configurations on the charge density distributions in the ground and excited states of acrolein
|
Tyutyulkov, N. |
|
1971 |
11 |
1 |
p. 86-88 3 p. |
artikel |
14 |
Enhanced solubility of quadrupolar molecules in benzene
|
Kihara, T. |
|
1971 |
11 |
1 |
p. 62-64 3 p. |
artikel |
15 |
ESR study of copper(II) ions in Y zeolite: Effect of water, ammonia and pyridine adsorption
|
Naccache, C. |
|
1971 |
11 |
1 |
p. 11-15 5 p. |
artikel |
16 |
Experimental potential energy curves for X2Π and 2Σ+ states of HF+
|
Berkowitz, J. |
|
1971 |
11 |
1 |
p. 21-26 6 p. |
artikel |
17 |
Hartree-Fock energy curves for X2Π and 2Σ+ states of HF+
|
Julienne, P.S. |
|
1971 |
11 |
1 |
p. 16-20 5 p. |
artikel |
18 |
Influence of environment on the radiative and radiationless transition rates of the pyrene excimer
|
Birks, J.B. |
|
1971 |
11 |
1 |
p. 89-92 4 p. |
artikel |
19 |
Infrared spectrum of nitrosyltricarbonylcobalt in the solid state
|
Cataliotti, R. |
|
1971 |
11 |
1 |
p. 58-61 4 p. |
artikel |
20 |
Laser-induced two-photon decomposition of azoethane
|
Speiser, S. |
|
1971 |
11 |
1 |
p. 117-119 3 p. |
artikel |
21 |
Least distorted localized orbital self-consistent field equations
|
Adams, W.H. |
|
1971 |
11 |
1 |
p. 71-74 4 p. |
artikel |
22 |
LiO formation in dry carbon monoxide flames
|
Dougherty, G.J. |
|
1971 |
11 |
1 |
p. 124-126 3 p. |
artikel |
23 |
Molecular Ramsauer-Townsend effect in very low energy 4He-4He scattering
|
Miller, W.H. |
|
1971 |
11 |
1 |
p. 152- 1 p. |
artikel |
24 |
Mössbauer studies of frozen aqueous solutions of Fe(NO3)3
|
Knudsen, J.M. |
|
1971 |
11 |
1 |
p. 134-136 3 p. |
artikel |
25 |
NMR shifts of protons in tanol free radical single crystals at 4.2°K
|
Ferrieu, F. |
|
1971 |
11 |
1 |
p. 46-51 6 p. |
artikel |
26 |
On a property of gaussian wavefunctions
|
Tsapline, B. |
|
1971 |
11 |
1 |
p. 75-81 7 p. |
artikel |
27 |
On the applicability of the Roothaan-Bagus procedure
|
Tsilimigras, P. |
|
1971 |
11 |
1 |
p. 99-100 2 p. |
artikel |
28 |
On the effect of bromine atoms on the opening and formation of hydrogen bonds
|
Bernard-Houplain, M.-C. |
|
1971 |
11 |
1 |
p. 149-151 3 p. |
artikel |
29 |
On the justifiability of neglect of differential overlap molecular orbital methods
|
Roby, K.R. |
|
1971 |
11 |
1 |
p. 6-10 5 p. |
artikel |
30 |
On the role of configuration interaction in semi-empirical methods. (CI calculations of energy surfaces)
|
Jakubetz, W. |
|
1971 |
11 |
1 |
p. 38-41 4 p. |
artikel |
31 |
On the theory of collision-induced dissociation
|
Levine, R.D. |
|
1971 |
11 |
1 |
p. 109-112 4 p. |
artikel |
32 |
Optical nuclear alignment of 35Cl in zero field
|
Maki, A.H. |
|
1971 |
11 |
1 |
p. 93-96 4 p. |
artikel |
33 |
Pi-electron SCF MO calculations for mono-substituted derivatives of benzene
|
Kiss, A.I. |
|
1971 |
11 |
1 |
p. 52-54 3 p. |
artikel |
34 |
Practical improvements for the calculation of intermolecular energies
|
Huron, M.J. |
|
1971 |
11 |
1 |
p. 152- 1 p. |
artikel |
35 |
Pulse radiolysis study of the mechanism of electron trapping in alcohol glasses at 77°K
|
Kevan, L. |
|
1971 |
11 |
1 |
p. 140-142 3 p. |
artikel |
36 |
Radiative and radiationless transitions in solutions of rare earth ions: Vibrational coupling of H2O and D2O to electronic levels of Gd3+
|
Haas, Y. |
|
1971 |
11 |
1 |
p. 143-145 3 p. |
artikel |
37 |
Second-order Jahn—Teller effect in the 2Eg state of d3 ions
|
Flint, C.D. |
|
1971 |
11 |
1 |
p. 27-28 2 p. |
artikel |
38 |
Spin-lattice relaxation of 15N nuclei in organic compounds
|
Lippmaa, E. |
|
1971 |
11 |
1 |
p. 120-123 4 p. |
artikel |
39 |
Studies in Mössbauer spectroscopy. Correlations between electronegativity and the Mössbauer isomer shift for tin(IV) halide systems
|
Parish, R.V. |
|
1971 |
11 |
1 |
p. 137-139 3 p. |
artikel |
40 |
Study of frozen solutions of ferrous compounds by Mössbauer effect and differential thermal analysis (DTA)
|
Thomas, P.M. |
|
1971 |
11 |
1 |
p. 42-45 4 p. |
artikel |
41 |
The application of Heisenberg's equation of motion to the extended Hückel model
|
Herrmann, E.C. |
|
1971 |
11 |
1 |
p. 1-5 5 p. |
artikel |
42 |
Velocity dependence of the total cross section for argon-krypton scattering
|
Bredewout, J.W. |
|
1971 |
11 |
1 |
p. 127-130 4 p. |
artikel |