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991.
The atomic correlation terms necessary to lead to anaccurate 4s23d8-4st 3d9 separation for the Ni atom have been incorporated into all-electron MC SCF/Cl calculations for the X2 Δ state of NiH. The calculated potential curve properties are significantly improved compared to calculations which dissociate to Hartree-Fock atoms. 相似文献
992.
R. Wäppling L. Häggström T. Ericsson S. Devanarayanan E. Karlsson B. Carlsson S. Rundqvist 《Journal of solid state chemistry》1975,13(3):258-271
The para- to ferromagnetic transition in Fe2P has been studied using Mössbauer spectroscopy. The magnetic hyperfine fields drop abruptly from about half of their saturation values to zero at 214.5 K indicating a first order transition. The isomer shifts show a discontinuous change at the transition point. For some samples the transition takes place over a wide temperature range, probably due to impurities and other imperfections in the samples. From the magnetic hyperfine fields at 15 K the magnetic moments can be deduced to be 1.14 μB and 1.78 μB for Fe(1) and Fe(2), respectively. An assignment of the components in the Mössbauer spectra to the two crystallographically nonequivalent iron positions has been made from the temperature variation of the spectra.The ordering of metal vacancies has been investigated by a Mössbauer study of a nonstoichiometric Fe2P sample and by an X-ray diffraction study of a nonstoichiometric Mn2P crystal. 相似文献
993.
The molecular structures of the title compounds have been determined by gas phase electron diffraction methods. The SiMn and GeMn bond lengths are 240.7 ? 0.5 and 248.7 ? 0.2 pm respectively and the CMnC angles in the silyl and germyl cases are 94.5 ± 2° and 97 ± 2° respectively. Comparisons are made with the reported structure of CH3Mn(CO)5 and HeI photoelectron spectra of these compounds in an attempt to determine the extent of d → d π-bonding in the SiMn or GeMn bonds. 相似文献
994.
B.W. Budesinsky 《Analytica chimica acta》1974,71(2):343-347
Antipyrylazo III or diantipyrylazo (3,6-bis(4-antipyrylazo)-4,5-dihydroxy-2, 7-napthalenedisulfonic acid) forms at PH 12.7 a complex Ca2HL with calcium. The logarithmic overall stability constant, 10g β211, is 23.99 ±0.03 (0.1 MNaClO4,25°C).The effective molar absorptivity is 21,500 ±100 l mole-1 cm-1 at 605 nm. The complex can be used for a selective photometric determination of calcium(0.25–3.50μmole) if tri-and tetravalent ions are removed by extraction with cupferron (into chloroform) and transition divalent ions are masked with sodium cyanide. Only strontium (0.5 μmole) and EDTA (0.1 μmole) interfere seriously. 相似文献
995.
Shubhasish MukherjeeKevin W.C Poon Daniel L Flynn Paul R Hanson 《Tetrahedron letters》2003,44(38):7187-7190
Application of a capture-ROMP-release strategy for the chromatography-free purification of Mitsunobu reaction products is described. Norbornenyl-tagged reagents are utilized for standard solution phase Mitsunobu chemistry. Post-reaction phase-switching is accomplished via in situ ring-opening metathesis polymerization (ROMP) followed by precipitation of the polymer with methanol. Release of the product from the polymer affords amines and alkyl hydrazine derivatives with good yields and purities. 相似文献
996.
W. L. H. Moll 《Colloid and polymer science》1938,85(2-3):335-341
Zusammenfassung Das Verhalten von 17 hochmolekularen Stoffen in 64 organischen Lösungsmitteln wird untersucht. Eine Ordnung des großen Beobachtungsmaterials gelingt, wenn man den Zustand der Systeme (z. B. Lösung oder Quellung) als Funktion der Oberflächenspannung und der dielektrischen Funktion
2/ der Lösungsmittel darstellt. 相似文献
997.
The preparation of functionalized 4,5,6,7-tetrahydroisoindole via a traceless solid-phase sulfone linker strategy is described. Thermolytic extrusion of SO(2) from polymer-bound 3-(phenylsulfonyl)-3-sulfolene (7) generated polymer-bound 2-(phenylsulfonyl)-1,3-butadiene (9) in situ which underwent Diels--Alder cycloaddition with various dienophiles to furnish vinyl sulfone resins 10-14. To complete a traceless linker cleavage strategy, (p-tolysulfonyl)methyl isocyanide or ethyl isocyanoacetate was employed to react with the vinyl sulfone moiety to liberate functionalized 4,5,6,7-tetrahydroisoindole products from the resin. Using this chemistry, nine tetrahydroisoindole derivatives (6, 15-22) were prepared in 32-41% overall yields from polystyrene/divinylbenzene sulfinate 1. 相似文献
998.
Oxygen atoms are detected by NO + O + M chemiluminescence as a secondary product of the reaction between Cl and O3. The mechanism Cl + O3 → ClO + O2(1Σ+g), O2(1Σ+g) + O3 → O2 + O2 + O is proposed to account for the oxygen atom formation. The branching ratio to the O2(1Σ+g) product in the reaction of Cl with O3 is estimated to be in the range (0.1–0.5) x 10?2. 相似文献
999.
By the aid of the optical interference method the size of the craze zone at the crack tip has been measured during fatigue crack propagation (FCP) in two glassy thermoplastics thus giving a basis to re-examine proposed models. In contrast to previous assumptions it has been found, that in PMMA of high molecular weight crack propagation occurs only during a short interval of the loading cycle when the fibrils are stretched most severely and it is not limited by crack tip blunting; between the dimensions of the craze zone and the crack advance per cycle which is also reflected by markings on the fracture surface no simple correlation has been found. In PVC first the craze grows continuously during many loading cycles up to its final size and then the crack propagates by a jump separating the craze zone only partly. Thus at all stress intensity levels investigated the length of the final craze zone has been found to be distinctly larger than the jump spacing on the fracture surface. By aid of SEM-photography it is shown that in PVC during FCP cracking occurs by separation of fibrils instead of void coalescence. 相似文献
1000.
In a continuing effort to predict the physicochemical properties of seawater from the properties of single aqueous electrolyte solutions, the pairwise heats of mixing at constant molal ionic strength,I=1.0 ional, have been determined for the six possible pairs of salts from the set (NaCl, Na2SO4, MgCl2, MgSO4) at 30°C. In addition, heats of dilution for two aqueous solutions formed from these salts and havingI=1.0 ional have been determined at 30°C. In order to present the most thermodynamically consistent results, it was found necessary to apply a correction term to the relative apparent equivalent enthalpies given in the literature at 30°C. These correction terms derived from a consideration of published results on heats of dilution at very low concentrations. Further, in order to make predictions for seawater at 25°C, it was deemed desirable to refit existing heat-capacity data. The heats relative apparent equivalent enthalpies for the two mixtures mentioned as well as for seawater. The estimates are based on the theoretical equation of Reilly and Wood for charge-asymmetric mixtures which derives from the work of Friedman. In the most applicable cases, the estimates agree with experimental relative apparent equivalent enthalpies to within 5%. In general, the results substantiate the theoretical equation.Taken in part from the Ph.D. dissertation of W. H. Leung, University of Miami, Miami, Florida 33149. 相似文献