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Auxiliary system, alternatives

The only result is that the electron full density determines the potential, but there is still the original many-body problem. One possibility is to replace the original interacting-particle problem with one that can be more easily solved, that is, the Kohn-Sham auxiliary system. This alternative is a non-interacting electron system assumed to have the same density as the interacting system. The Kohn-Sham system presumes to have the same density as the true interacting system. Thus,... [Pg.121]

There are several alternatives for the auxiliary system q(x, z). The common feature is that for f = 0, the solution of system ... [Pg.282]

In addition to the auxiliary boration system, alternative injection with the operational volume control system from the RWST or the containment sump into the primary circuit ... [Pg.128]

When possible, gears should be run-in on initial startup. Speeds and loads should be inereased in pereentage inerements. Lube oil temperature, and pressure and bearing temperatures should be observed and adjustments made to the lube system as required. The number of adjustments made will depend on the eomplexity of the system. Oil pressure is of primary importanee. When an auxiliary pump has been provided, oil should be eireulated before the aetual start. If not, the pump should be primed, and the journals wetted with oil. Primer holes are sometimes provided or alternate journals ean be oiled through the holes provided for bearing temperature deteetors. [Pg.537]

Alternatively, the auxiliary power device can be some other RES with the appropriate equipment or a diesel engine, which can be obtained in various sizes and specifications. It is presumed that in a stand-alone system the requirements for power quality are not the same as that for a grid-connected consumer [43]. [Pg.175]

Alternatively, the use of an auxiliary with an (f )-stereochemistry at the phenyl-2-(phenylsulfanyl)ethyl moiety will lead to the formation of a 1,2-traro-glycoside because in this case the trans-decalin system will exert unfavourable steric interactions. The proposed mechanism has been supported by computational studies.39... [Pg.38]

In the original formulation of the R12 method [23], which is often referred to as "the standard approximation" or SA, a large uncontracted OBS was needed as the RI basis, strongly limiting the applicability of the R12 method to relatively small systems. Klopper and Samson [26] later pioneered the use of a separate RI basis set and considerably improved the applicability and accuracy of MP2-R12. Valeev developed an alternative formulation of the RI procedure [27] known as the complementary auxiliary basis set (CABS) approach, which had smaller RI errors. Ten-no, on the other hand, proposed the use of a numerical quadrature for the same purpose [28]. Kedzuch et al. later used the CABS approach to develop a particularly elegant and practical formalism for the MP2-R12 energies [30]. [Pg.137]

The compound consists of two diastereomeric photobistable forms for instance, P (right-handed) and M (left-handed) helices, which can undergo photoisomerization at two different wavelengths A. and k2- Alternatively, a chiral auxiliary (X ) and a photochromic unit (A) (either chiral or achiral) may be present in systems A-X, with the auxiliary X controlling the change in chirality during the switching event. [Pg.125]

An alternative stereoselective synthesis of chiral heterocycles based on carbohydrate-induced stereodifferentiation includes nucleophilic addition reactions on heterocyclic systems already bound to the carbohydrate auxiliary. An example of this strategy has been shown by stereoselective addition of Grignard reagents to carbohydrate-linked 4-pyridones [61]. For this purpose, trimethylsiloxypyridine was glycosylated regioselectively using pivaloyl-protected glycosyl fluorides. [Pg.125]

Table VI summarizes a typical heat balance in second stage of the above calcining system (Case A) in comparison with that of an alternative system (Case B) in which the exhaust gas from first stage kiln is not utilized for second stage calcination. The amount, composition and temperature of the exhaust gas from first stage kiln determine the auxiliary fuel requirements for second stage kiln. Table VI summarizes a typical heat balance in second stage of the above calcining system (Case A) in comparison with that of an alternative system (Case B) in which the exhaust gas from first stage kiln is not utilized for second stage calcination. The amount, composition and temperature of the exhaust gas from first stage kiln determine the auxiliary fuel requirements for second stage kiln.
The low exergetic efficiency is typical for distillation systems with close boiling mixtures and with high energy requirements in the reboiler. An alternative is to use reboiler-liquid flashing. A compressor is used to return the reboiled vapor to the bottom of the column. The required reboiler duty is somewhat larger than the required condenser duty, and so an auxiliary steam-heated reboiler is needed. Thus, a trade-off is made between the power used in the compressor and the large reduction in reboiler steam. [Pg.235]

Figure 5.18 HDA process Alternative 6 with complete heat management control system using auxiliary coolers and reboilers. [Pg.166]

Linkage of enzyme and antibody by auxiliary molecules provides a potentially universal and variable number of systems for use in bioassays. The most common linkage system involves the recognition of biotin by avidin, or more commonly streptavidin (due to its higher affinity for biotin), although the use of staphylococcal protein A can be used for some antibody isotypes (11). An alternative system, but one that is not often used, involves liposomes loaded with enzyme that has antibody molecules on its surface (49). [Pg.196]

S-Naproxen is being produced by Syntex by resolution with a chiral auxiliary. The main patents from Syntex expired in 1993, which represents the main drive for an increase in the efforts to find alternative synthetic routes which may lead directly to an asymmetric carbohydroxylation of the styrene precursor. Asymmetric hydrogenation of molecules of this type has been successfully accomplished by Noyori using ruthenium complexes of the ligand BINAP (Fig. 6.30). With this system a high enantioselectivity can be achieved (97%) albeit at rather high pressures (135 bar). Monsanto [79] claims a similar route that operates at a much lower pressure. The reaction scheme is shown in Fig. 6.31. [Pg.336]


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See also in sourсe #XX -- [ Pg.282 ]




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