The flat model structure on

Given a cotorsion pair in an abelian category with enough objects and enough objects, we define two cotorsion pairs in the category of unbounded chain complexes. We see that these two cotorsion pairs are related in a nice way when is hereditary. We then show that both of these induced cotorsion pairs are complete when is the ``flat' cotorsion pair of -modules. This proves the flat cover conjecture for (possibly unbounded) chain complexes and also gives us a new ``flat' model category structure on . In the last section we use the theory of model categories to show that we can define using a flat resolution of and a cotorsion coresolution of .

     

An example in the theory of -operators

-operators are a generalization in the context of well-boundedness of normal operators on Hilbert space. It was shown by Doust and Walden that compact -operators have a representation as a conditionally convergent sum reminiscent of the spectral representations for compact normal operators. In this representation, the eigenvalues must be taken in a particular order to ensure convergence of the sum. Here we show that one cannot replace the ordering given by Doust and Walden by the more natural one suggested in their paper.

     

The synthesis and reactivity of polysilylacetylenes: Diels—Alder reactions to give bis (silyl) benzenes

Six bis(silyl)acetylenes (XMe²Si? C?C? SiMe₂X) with the following varied silicon substituents X were prepared: 1 (Me, Me); 2 (H, H); 3 (C1, H); 4 (CI, CI); 5 (MeO, H); 6 (MeO, MeO). While 1 and 2 may be prepared by the reaction of dilithio- or bis(bromomagnesium)-acetylide with the appropriate chlorosilane, similar reactions designed to give 3–6 yielded oligomers, XMe₂Si? (? C?C? SiMe₂)_n? X, 7, X=CI, MeO, as the major products, indicating that the acetylenic functionality on silicon activates the chlorosilane towards nucleophilic substitution. Compounds 3 and 4 were prepared by free radical chlorination of 2. Methanolysis of 3 and 4 gave quantitative yields of 5 and 6 respectively. Compounds 1–6 undergo a Diels–Alder reaction with α-pyrone to produce, after loss of carbon dioxide, bis(silyl)-substituted benzene derivatives. The order of reactivity has been determined to be: 4=6>3=5>1>2, indicating that chloro or alkoxy substituents favor the cycloaddition with 2- pyrone. The adducts formed by compounds 3–6 undergo an unusually facile hydrolysis or elimination to give 1,1,3,3-tetramethyl-1,3-disila-2-oxaindane.     

Spectroscopic analysis and kinetics of intermolecular hydrogen bond formation in poly‐pyridobisimidazole (M5) fiber

Poly‐pyridobisimiazole (M5) single filaments subjected to varying degrees of heat treatment have been analyzed using Fourier Transform Infrared (FTIR) microspectroscopy in transmission mode to detect changes in the state of intermolecular hydrogen bonding as a function of fiber annealing conditions. The FTIR absorbance bands associated with hydrogen bonding in M5 fiber have been identified, and the integrated molar absorption coefficients for the bands of interest have been determined experimentally, which allows to quantify the concentration of N? H vibration groups hydrogen‐bonded (H‐bonded) to water molecules, and the concentration of N? H vibration groups H‐bonded to adjacent polymer chains in the fiber. A dual mechanism kinetic rate expression is used to describe intermolecular H‐bond formation in M5 fiber as a function of annealing conditions, from which an activation energy for H‐bond formation of 14.8 kJ/mol is obtained. © 2009 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 47: 1809–1824, 2009     

Using phase-type models to cost stroke patient care across health,social and community services

Stroke disease places a heavy burden on society, incurring long periods of time in hospital and community care, and associated costs. Also stroke is a highly complex disease with diverse outcomes and multiple strategies for therapy and care. Previously a modeling framework has been developed which clusters patients into classes with respect to their length of stay (LOS) in hospital. Phase-type models were then used to describe patient flows for each cluster. Also multiple outcomes, such as discharge to normal residence, nursing home, or death can be permitted. We here add costs to this model and obtain the Moment Generating Function for the total cost of a system consisting of multiple transient phase-type classes with multiple absorbing states. This system represents different classes of patients in different hospital and community services states. Based on stroke patients’ data from the Belfast City Hospital, various scenarios are explored with a focus on comparing the cost of thrombolysis treatment under different regimes. The overall modeling framework characterizes the behavior of stroke patient populations, with a focus on integrated system-wide costing and planning, encompassing hospital and community services. Within this general framework we have developed models which take account of patient heterogeneity and multiple care options. Such complex strategies depend crucially on developing a deep engagement with the health care professionals and underpinning the models with detailed patient-specific data.     

Monodromy and K-theory of Schubert curves via generalized jeu de taquin

We establish a combinatorial connection between the real geometry and the K-theory of complex Schubert curves \(S(\lambda _\bullet )\), which are one-dimensional Schubert problems defined with respect to flags osculating the rational normal curve. In Levinson (One-dimensional Schubert problems with respect to osculating flags, 2016, doi: 10.4153/CJM-2015-061-1), it was shown that the real geometry of these curves is described by the orbits of a map \(\omega \) on skew tableaux, defined as the commutator of jeu de taquin rectification and promotion. In particular, the real locus of the Schubert curve is naturally a covering space of \({\mathbb {RP}}^1\), with \(\omega \) as the monodromy operator. We provide a fast, local algorithm for computing \(\omega \) without rectifying the skew tableau and show that certain steps in our algorithm are in bijective correspondence with Pechenik and Yong’s genomic tableaux (Pechenik and Yong in Genomic tableaux, 2016. arXiv:1603.08490), which enumerate the K-theoretic Littlewood–Richardson coefficient associated to the Schubert curve. We then give purely combinatorial proofs of several numerical results involving the K-theory and real geometry of \(S(\lambda _\bullet )\).     

Model structures on exact categories

We define model structures on exact categories, which we call exact model structures. We look at the relationship between these model structures and cotorsion pairs on the exact category. In particular, when the underlying category is weakly idempotent complete, we get Hovey’s one-to-one correspondence between model structures and complete cotorsion pairs. We classify the right and the left homotopy relation in terms of the cotorsion pairs and look at examples of exact model structures. In particular, we see that given any hereditary abelian model category, the full subcategories of cofibrant, fibrant and cofibrant-fibrant subobjects each has natural exact model structures equivalent to the original model structure. These model structures each has interesting characteristics. For example, the cofibrant-fibrant subobjects form a Frobenius category, whose stable category is the same as the homotopy category of its model structure.     

Toward making the mean spherical approximation of primitive model electrolytes analytic: an analytic approximation of the MSA screening parameter

The mean spherical approximation (MSA) for the primitive model of electrolytes provides reasonable estimates of thermodynamic quantities such as the excess chemical potential and screening length. It is especially widely used because of its explicit formulas so that numerically solving equations is minimized. As originally formulated, the MSA screening parameter Γ (akin to the reciprocal of the Debye screening length) does not have an explicit analytic formula; an equation for Γ must be solved numerically. Here, an analytic approximation for Γ is presented whose relative error is generally ?10(-5). If more accuracy is desired, one step of an iterative procedure (which also produces an explicit formula for Γ) is shown to give relative errors within machine precision in many cases. Even when ion diameter ratios are ～10 and ion valences are ～10, the relative error for the analytic approximation is still ?10(-3) and for the single iterative substitution it is ?10(-9).     

Automated estimation of rare event probabilities in biochemical systems

In biochemical systems, the occurrence of a rare event can be accompanied by catastrophic consequences. Precise characterization of these events using Monte Carlo simulation methods is often intractable, as the number of realizations needed to witness even a single rare event can be very large. The weighted stochastic simulation algorithm (wSSA) [J. Chem. Phys. 129, 165101 (2008)] and its subsequent extension [J. Chem. Phys. 130, 174103 (2009)] alleviate this difficulty with importance sampling, which effectively biases the system toward the desired rare event. However, extensive computation coupled with substantial insight into a given system is required, as there is currently no automatic approach for choosing wSSA parameters. We present a novel modification of the wSSA--the doubly weighted SSA (dwSSA)--that makes possible a fully automated parameter selection method. Our approach uses the information-theoretic concept of cross entropy to identify parameter values yielding minimum variance rare event probability estimates. We apply the method to four examples: a pure birth process, a birth-death process, an enzymatic futile cycle, and a yeast polarization model. Our results demonstrate that the proposed method (1) enables probability estimation for a class of rare events that cannot be interrogated with the wSSA, and (2) for all examples tested, reduces the number of runs needed to achieve comparable accuracy by multiple orders of magnitude. For a particular rare event in the yeast polarization model, our method transforms a projected simulation time of 600 years to three hours. Furthermore, by incorporating information-theoretic principles, our approach provides a framework for the development of more sophisticated influencing schemes that should further improve estimation accuracy.     

N.M.R. studies of liquid boron trifluoride

Previous ¹⁹F N.M.R. studies of liquid BF₃ have been extended by obtaining the ¹¹B spectrum of BF₃ and the ¹⁹F spectrum of ¹⁰BF₃ at various temperatures. Values for the B-F coupling constant and the boron relaxation times have been obtained by computer matching and visual matching of observed and calculated spectra. Relaxation times have the Arrhenius temperature dependence found previously. The temperature dependence of the B-F coupling constant is discussed. Some of the possible advantages of ‘high spin spectra’ are discussed.