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Standard domains

In those cases where the injection of self-nuclei in every MD is most difficult in view of the very large number of MDs, domain III is split into two domains. Evaluation of the self-nucleation of the PE block within S35E15C50219 shows that not only domain II is absent, but upon decreasing Ts, the PE block is annealed before any detectable self-nucleation occurs (Fig. 17c). Therefore two subdomains were defined [98] domain IIIa, where annealing without previous self-nucleation occurs and domain IIIsa> where self-nucleation and annealing are simultaneously observed for Ts < 88 °C. Domain IIIsa would be the exact equivalent to the standard domain III established by Fillon et al. [75]. [Pg.66]

Take now any local, nonzero volume domain c of arbitrary but fixed shape and size within the ordinary, three-dimensional space, and refer to it as the standard domain c. For example, take c as the unit cube, using a unit length convenient for molecular size. Consider all possible ground state, nondegenerate local electron densities pc(r) within this domain c. The Local Density Information Completeness Theorem [26] implies that the energy E of complete molecules is a unique functional of the local electron density pc(r) within the standard domain c ... [Pg.171]

Energy is not the only property that is so determined by the electron density fragment pc. Since the (non-degenerate, ground state) local electron density pc(r) in any standard domain c fully determines the complete density pit), which in turn fully determines the molecular wavefunction P (up to a phase factor), all molecular properties P which can be expressed as expectation values of spin-free operators defined by the ground state wavefunction P are also determined by the local electron density pc(r) in the standard domain c. Consequently, any such property P is also a unique functional of the local electron density pc(r) within the standard domain c ... [Pg.171]

This result, known as the Local Density Functional Property Theorem Over Standard Domains [26], is the fundamental statement on the role of local molecular domains in determining the properties of complete molecules. [Pg.172]

To address those issues, in [4], we present a metamodel transformation approach to facilitate the process of creating metamodels for a specific safety standard, domain or company. As a result, a family of metamodels is generated throughout a metamodel transformation sequence. The traceability information of those metamodels needs to be stored, maintained and analyzed for metamodel consistency. Besides, one of the key tasks to reduce the safety assurance cost is to find the reusable data from models conforming to similar metamodels. Thus, metamodel comparison and model comparison are vital. The comparison results can be described as mappings between metamodels or between models and used for supporting safety-assurance data reuse. [Pg.420]

However, many questions still remain open, requiring more research effort to be invested. The main directions that concern in the short to medium term revolve around the following (a) a methodology that allows an efficient (even automatic) construction of the necessary models and semantic bridges (b) standardized, domain-specific extensions which would allow a very short start-up time for projects ... [Pg.92]

UTDefect is basically working in the frequency domain so pulse problems are solved by superposing a number of frequencies. In principal any frequency spectrum can be used (an experimental one, for instance). As the standard spectrum the following simple one is used... [Pg.157]

Standard procedures that are used for testing of construction materials are based on square pulse actions or their various combinations. For example, small cyclic loads are used for forecast of durability and failure of materials. It is possible to apply analytical description of various types of loads as IN actions in time and frequency domains and use them as analytical deterministic models. Noise N(t) action as a rule is represented by stochastic model. [Pg.189]

Binsch [6] provided the standard way of calculating these lineshapes in the frequency domain, and implemented it in the program DNMR3 [7], Fonnally, it is the same as the matrix description given in section (B2.4.2.3). The calculation of the matrices L, R and K is more complex for a coupled spin system, but that should not interfere witii the understanding of how the method works. This work will be discussed later, but first the time-domain approach will be developed. [Pg.2099]

An interesting approach has recently been chosen in the MBO(N)D program ([Moldyn 1997]). Structural elements of different size varying from individual peptide planes up to protein domains can be defined to be rigid. During an atomistic molecular dynamics simulation, all fast motion orthogonal to the lowest normal modes is removed. This allows use of ca. 20 times longer time steps than in standard simulations. [Pg.73]

The denomination of odors was schematically related to two separate domains, both related to the memory stimulus of an event concomitant with the perception of the odor. One domain was based on an actual reference point that contains the odor vectors the other was associated with an odor stimulus based on imagination, ie, what image is evoked by the stimulus. With such a system, the final descriptive terminology used would more often than not be expressed in esoteric language, causing confusion and even communication breakdown. The work of Jaubert (1) was the origin of a more standardized descriptive system in the field of aroma description. [Pg.400]

Every phase of internal coordinate modeling admits many methodological variations, and I do not attempt to review them all. I outline only the standard problems encountered in any particular domain of application and the common practical solutions. [Pg.119]

Time domain response of first-order systems 3.5.1 Standard form... [Pg.43]

The document availability requirement applies to both internal and external documents alike. Customer documents such as contracts, drawings, specifications, and standards need to be available to those who need them to execute their responsibilities. Often these documents are only held in paper form and therefore distribution lists will be needed to control their location. If documents in the public domain are required, they only need be available when required for use and need not be available from the moment they are specified in a specification or procedure. You should only have to produce such documents when they are needed for the work being undertaken at the time of the audit. However, you would need to demonstrate that you could obtain timely access when needed. If you provide a lending service to users of copyrighted documents, you would need a register indicating to whom they were loaned so that you can retrieve them when needed by others. [Pg.295]

In the standard approaches to the systems in which monolayers or bilayers are formed, one assumes that the width of the film is much smaller than the length characterizing the structure (oil or water domain size, for example). In such a case it is justified to represent the film by a mathematical surface and the structure can be described by the local invariants of the surface, i.e., the mean H and the Gaussian K curvatures and by the global (topological)... [Pg.730]

Figure 6.3 shows a comparison of elution patterns of standard polystyrene between a linear-type column and a standard-type column. Because of the high linearity of its calibration curve, the linear series has improved the efficiency of oligomer domain separation. [Pg.172]


See other pages where Standard domains is mentioned: [Pg.171]    [Pg.322]    [Pg.135]    [Pg.171]    [Pg.322]    [Pg.135]    [Pg.15]    [Pg.189]    [Pg.2096]    [Pg.2277]    [Pg.2814]    [Pg.40]    [Pg.49]    [Pg.62]    [Pg.171]    [Pg.283]    [Pg.293]    [Pg.531]    [Pg.789]    [Pg.117]    [Pg.146]    [Pg.168]    [Pg.352]    [Pg.205]    [Pg.310]    [Pg.361]    [Pg.408]    [Pg.775]    [Pg.1039]    [Pg.729]    [Pg.172]    [Pg.1204]   
See also in sourсe #XX -- [ Pg.2 , Pg.53 , Pg.57 , Pg.59 , Pg.64 , Pg.68 , Pg.69 , Pg.71 , Pg.73 , Pg.74 , Pg.75 ]

See also in sourсe #XX -- [ Pg.53 , Pg.57 , Pg.59 , Pg.64 , Pg.68 , Pg.69 , Pg.71 , Pg.73 , Pg.74 , Pg.75 ]

See also in sourсe #XX -- [ Pg.2 , Pg.53 , Pg.57 , Pg.59 , Pg.64 , Pg.71 ]




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