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29 Oct 2002: Figure 4 shows the quantity. , defined as. (46). for the molecules silane (. ) and cyclohexane (. ), for different FFT box sizes. For these tests we used a cubic simulation cell of side length. ,

31 Oct 2002: Section 4 contains the results of calculations on different test systems, which are compared with those obtained using the same theory level and approximations, but with a plane-wave basis

31 Oct 2002: In section 5 we present tests on a variety of systems showing the accuracy and efficiency of this method and finally we conclude and mention what we see as future developments.

1 Nov 2002: The locations of the atoms are marked by crosses. We have chosen bulk crystalline silicon to test the performance of the basis set on an extended system.

25 Oct 2002: A test for Diels-Alder reactions and Pt(P(t-Bu)(3))(2)H-2 oxidative addition", J. Phys. ... Chem. 100, 19357 (1996);. T. Matsubara, S. Sieber and K. Morokuma, "A test of the new 'integrated M0MM' (IMOMM) method for the conformational energy of ethane and

14 May 2002: In other words, language use presupposes that a listener will generate an equivalent and be predisposed to act as if the information came from a different source, this providing a test

11 May 2002: Consequently, light water can not be used as a null (blank) test of the method as some people have suggested. ... O electrolyte. To test this idea, they loaded a Pd electrode in D.

24 Jan 2002: interpret your results. [5]. F1. 3. 3 Small spherical particles of mass m and radius a, suspended at lowconcentration in a liquid of viscosity η filling a vertical test tube, undergoBrownian ... Hence obtain the dependence of theequilibrium particle