In this work a combined molecular dynamics simulation and dynamically corrected transition-state theory (dcTST) study was performed to investigate the effect of interpenetration (catenation) on hydrogen diffusion in metal-organic frameworks (MOFs) as well as their relationships. The results on 10 isoreticular MOFs (IRMOFs) with and without interpenetration show that catenation can reduce hydrog...

We give a new combinatorial de nition of a sort of weak !category originally devised by J. Baez and J. Dolan in nite dimensional cases. Our de nition is a mixture of both inductive and coinductive de nitions, and suitable for `computational category theory.' Keyword: weak n-category, bicategory, tricategory, formalized mathematics

We generalise the concepts introduced by Baez and Dolan to define opetopes constructed from symmetric operads with a category, rather than a set, of objects. We describe the category of 1-level generalised multicategories, a special case of the concept introduced by Hermida, Makkai and Power, and exhibit a full embedding of this category in the category of symmetric operads with a category of o...

This paper argues an existence of a class of functions where function own input makes function description. That fact have impact to the wide spectrum of phenomena such as negative findings of Random Oracle Model in cryptography, complexity in some rules of cellular automata (Wolfram rule 30) and determinism in the true randomness to name just a few.

A scanning coherent diffraction imaging method was used to reconstruct the X-ray wavefronts produced by a Fresnel zone plate (FZP) and by Kirkpatrick-Baez (KB) focusing mirrors. The ptychographical measurement was conducted repeatedly by placing a lithographed test sample at different defocused planes. The wavefronts, recovered by phase-retrieval at well-separated planes, show good consistency ...

tomato  (l.ycopersicon esculentum  mill.) cv. rio grande  seedlings were nutritionally conditioned with solutions complete fertilizer n(60% no3+40% nh4)-p-k (20-20-20) , n(30%no3+70% nh4)-p-k (15-5-30) , the first two week   n(60% no3+40% nh4)-p-k (20-20-20) and later two week  n(30%no3+70% nh4)-p-k (15-5-30)  and vice versa were  applied in  completely randomized experiment with three replicat...

The hydroperoxide-supported N-demethylation reactions catalyzed by horseradish peroxidase have been characterized in detail. The ethyl hydroperoxide-supported N-demethylation of N,N-dimethylaniline by horseradish peroxidase resulted in the formation of equimolar amounts of N-methylaniline and formaldehyde with no other products detectable by high performance liquid chromatography analysis of th...