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101.
Effect of the stoichiometry on the electronic structure of the Ni(111)/α-Al2O3(0001) interface: a first-principles investigation
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In this paper first-principles calculations of Ni(111)/α-Al2O3(0001) interfaces have been performed, and are compared with the preceding results of the Cu (111)/α-Al2O3(0001) interface [2004 Phil. Mag. Left. 84 425]. The AI- terminated and O-terminated interfaces have quite different adhesion mechanisms, which are similar to the Cu(111)/α Al2O3(0001) interface. For the O-terminated interface, the adhesion is caused by the strong O-2p/Ni-3d orbital hybridization and ionic interactions. On the other hand, the adhesion nature of the Al-terminated interface is the image-like electrostatic and Ni-Al hybridization interactions, the latter is substantial and cannot be neglected. Charge transfer occurs from Al2O3 to Ni, which is opposite to that in the O=terminated interface. The charge transfer direction for the Al-terminated and O-terminated Ni(111)/α-A1203(0001) interfaces is similar to that in the corresponding Cu(111)/α- Al2O3(0001) interface, but there exist the larger charge transfer quantity and consequent stronger adhesion nature, respectively. 相似文献
102.
103.
The reactions of carbon dioxide, primary or secondary aliphatic amines and oxetanes at a CO2 pressure of 40 atm at 100–120°C without any catalysts afforded new monocarbamates of 1,3-propanediols, with concomitant formation of amino alcohols from oxetanes and amines. 相似文献
104.
Synthesis of medium-sized carbocyclic ketones via the intramolecular B-alkyl Liebeskind-Srogl coupling reaction is described. The sequence of hydroboration of ω-alkenyl thiol ester with 9-BBN and the Liebeskind-Srogl reaction results in the formation of medium-sized carbocyclic ketones with good yield. 相似文献
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106.
107.
The fluorescence properties of novel 6-butyl-2,3-dicyano-7-methyl-6H-1,4-diazepine styryl dyes having mono-, di-, tri-, and tetra(ethyleneglycol) units were examined. The mono(ethylenglycol) derivative was solid at room temperature, whereas the di-, tri-, and tetra(ethylenglycol) derivatives were oily. The monoethyleneglycol derivative showed weak aggregation-induced emission enhancement with fluorescence maximum at 649 nm, which comes from J-aggregates. The fluorescence of oily di-, tri-, and tetra(ethyleneglycol) derivatives in neat form was very weak. No aggregation-induced emission enhancement was observed for the oily derivatives. 相似文献
108.
109.
A lifting is a map from the state of a system to that of a compound system, which was introduced in Accardi and Ohya (Appl.
Math. Optim. 39:33–59, 1999). The lifting can be applied to various physical processes. 相似文献
110.
Tetsuya Ezawa Seunghee Jung Yuya Kawashima Takuya Noguchi Nobuyuki Imai 《Tetrahedron: Asymmetry》2017,28(1):75-83
Dipeptides and amides were obtained in high yields from N-carbobenzyloxy α-amino acids and 3-phenylpropanoic acid with unprotected α-amino acids via the corresponding mixed carbonic carboxylic anhydrides using ethyl chloroformate and triethylamine by an ecological and convenient method in which the protection of C-terminals is not needed. 相似文献