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CUMULATIVE PART

In this paper, we examine the electron correlation of one-dimensional and quasi-one-dimensional Hubbard models with two sets of approximate iV-representability conditions. While recent RDM calculations have examined linear [20] as well as 4 x 4 and 6x6 Hubbard lattices [2, 57], there has not been an exploration of ROMs on quasi-one-dimensional Hubbard lattices with a comparison to the one-dimensional Hubbard lattices. How does the electron correlation change as we move from a one-dimensional to a quasi-one-dimensional Hubbard model How are these changes in correlation reflected in the required A -repre-sentability conditions on the 2-RDM One- and two-par-ticle correlation functions are used to compare the electronic structure of the half-filled states of the 1 x 10 and 2x10 lattices with periodic boundary conditions. The degree of correlation captured by approximate A -repre-sentability conditions is probed by examining the one-particle occupations around the Fermi surfaces of both lattices and measuring the entanglement with a size-extensive correlation metric, the Frobenius norm squared of the cumulant part of the 2-RDM [23]. [Pg.167]

Fig. 6 Frobenius norm squared of the cumulant part of the 2-RDM is shown for the (a) 2 x 10 and (b) 1x10 lattices where the 2-RDMs are computed with variational 2-RDM calculations with DQG and DQGT conditions... Fig. 6 Frobenius norm squared of the cumulant part of the 2-RDM is shown for the (a) 2 x 10 and (b) 1x10 lattices where the 2-RDMs are computed with variational 2-RDM calculations with DQG and DQGT conditions...
Recall a typical cumulative probability curve of reserves for an exploration prospect in which the probability of success (POS) is 30%. The success part of the probability axis can be divided into three equal bands, and the average reserves for each band is calculated to provide a low, medium and high estimate of reserves, //there are hydrocarbons present. [Pg.328]

Critical micelle concentration (Section 19 5) Concentration above which substances such as salts of fatty acids aggre gate to form micelles in aqueous solution Crown ether (Section 16 4) A cyclic polyether that via lon-dipole attractive forces forms stable complexes with metal 10ns Such complexes along with their accompany mg anion are soluble in nonpolar solvents C terminus (Section 27 7) The amino acid at the end of a pep tide or protein chain that has its carboxyl group intact—that IS in which the carboxyl group is not part of a peptide bond Cumulated diene (Section 10 5) Diene of the type C=C=C in which a single carbon atom participates in double bonds with two others... [Pg.1280]

If necessary, the fit can be improved by increasing the order of the polynomial part of Eq. (9-89), so that this approach provides a veiy flexible method of simulation of a cumulative-frequency distribution. The method can even be extended to J-shaped cui ves, which are characterized by a maximum frequency at x = 0 and decreasing frequency for increasing values of x, by considering the reflexion of the cui ve in the y axis to exist. The resulting single maximum cui ve can then be sampled correctly by Monte Carlo methods if the vertical scale is halved and only absolute values of x are considered. [Pg.824]

In order to reinforce such conclusion for this part of the phase boundary we also studied the cumulants as functions of the rotational constant at constant temperature in the range T < 0.2424. The fourth-order cumulant plots show that the intersection occurs in this low temperature range at a... [Pg.122]

This work was supported in part by NIH Grant GM-26898. The author particularly wishes to thank present and past members of the Laboratory of Molecular Biophysics whose cumulative efforts of more than a decade have made this review possible. [Pg.215]


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