241 research outputs found

    STRATIGRAPHY AND FUSULINIDS OF THE KASIMOVIAN AND LOWER GZHELIAN(UPPER CARBONIFEROUS) IN THE SOUTHWESTERN DARVAZ (PAMIR)

    Get PDF
    A detailed fusulinid biostratigraphic zonation of the Kasimovian and lowermost Gzhelian in southwestern Darvaz is proposed. Based on the investigation of five stratigraphic sections, five local fusulinid zones were established. These zones correlate with their chronostratigraphic equivalents in the East-European Platform and in the Urals, Arctic and Carnic Alps regions. Eighty-seven species and subspecies, which belong to 18 genera and 7 families of fusulinids, were identified in the Kasimovian and lowermost Gzhelian of Darvaz. Among them, two genera (Kushanella and Darvasoschwagerina), one subgenus (Tumefactus), and 24 species are new ( i. e. Fusiella segyrdashtiensis, Quasifusulina pseudotenuissima, Protriticites putrjai, P. compactus, Obsoletes darvasicus, Schwagerinoides (Schwagerinoides) pamiricus, Schw. (Tumefactus) oblisus, Montiparus kushanicus, M. rauserae, M. pigmaeus, M. memorabilis, M. citreum, M. hirsutus, M. dubius, M. stuckenbergiformis, M. desinens, Triticites umbonoplicatiformis, T. licis, Rauserites concinnus, R. jucundus, R. darvasicus, Kushanella globosa, K. insueta, Darvasoschwagerina donbasica)

    Development of an Advanced Force Field for Water using Variational Energy Decomposition Analysis

    Full text link
    Given the piecewise approach to modeling intermolecular interactions for force fields, they can be difficult to parameterize since they are fit to data like total energies that only indirectly connect to their separable functional forms. Furthermore, by neglecting certain types of molecular interactions such as charge penetration and charge transfer, most classical force fields must rely on, but do not always demonstrate, how cancellation of errors occurs among the remaining molecular interactions accounted for such as exchange repulsion, electrostatics, and polarization. In this work we present the first generation of the (many-body) MB-UCB force field that explicitly accounts for the decomposed molecular interactions commensurate with a variational energy decomposition analysis, including charge transfer, with force field design choices that reduce the computational expense of the MB-UCB potential while remaining accurate. We optimize parameters using only single water molecule and water cluster data up through pentamers, with no fitting to condensed phase data, and we demonstrate that high accuracy is maintained when the force field is subsequently validated against conformational energies of larger water cluster data sets, radial distribution functions of the liquid phase, and the temperature dependence of thermodynamic and transport water properties. We conclude that MB-UCB is comparable in performance to MB-Pol, but is less expensive and more transferable by eliminating the need to represent short-ranged interactions through large parameter fits to high order polynomials

    Approximately coloring graphs without long induced paths

    Get PDF
    It is an open problem whether the 3-coloring problem can be solved in polynomial time in the class of graphs that do not contain an induced path on tt vertices, for fixed tt. We propose an algorithm that, given a 3-colorable graph without an induced path on tt vertices, computes a coloring with max{5,2t122}\max\{5,2\lceil{\frac{t-1}{2}}\rceil-2\} many colors. If the input graph is triangle-free, we only need max{4,t12+1}\max\{4,\lceil{\frac{t-1}{2}}\rceil+1\} many colors. The running time of our algorithm is O((3t2+t2)m+n)O((3^{t-2}+t^2)m+n) if the input graph has nn vertices and mm edges

    Complexity of Coloring Graphs without Paths and Cycles

    Full text link
    Let PtP_t and CC_\ell denote a path on tt vertices and a cycle on \ell vertices, respectively. In this paper we study the kk-coloring problem for (Pt,C)(P_t,C_\ell)-free graphs. Maffray and Morel, and Bruce, Hoang and Sawada, have proved that 3-colorability of P5P_5-free graphs has a finite forbidden induced subgraphs characterization, while Hoang, Moore, Recoskie, Sawada, and Vatshelle have shown that kk-colorability of P5P_5-free graphs for k4k \geq 4 does not. These authors have also shown, aided by a computer search, that 4-colorability of (P5,C5)(P_5,C_5)-free graphs does have a finite forbidden induced subgraph characterization. We prove that for any kk, the kk-colorability of (P6,C4)(P_6,C_4)-free graphs has a finite forbidden induced subgraph characterization. We provide the full lists of forbidden induced subgraphs for k=3k=3 and k=4k=4. As an application, we obtain certifying polynomial time algorithms for 3-coloring and 4-coloring (P6,C4)(P_6,C_4)-free graphs. (Polynomial time algorithms have been previously obtained by Golovach, Paulusma, and Song, but those algorithms are not certifying); To complement these results we show that in most other cases the kk-coloring problem for (Pt,C)(P_t,C_\ell)-free graphs is NP-complete. Specifically, for =5\ell=5 we show that kk-coloring is NP-complete for (Pt,C5)(P_t,C_5)-free graphs when k4k \ge 4 and t7t \ge 7; for 6\ell \ge 6 we show that kk-coloring is NP-complete for (Pt,C)(P_t,C_\ell)-free graphs when k5k \ge 5, t6t \ge 6; and additionally, for =7\ell=7, we show that kk-coloring is also NP-complete for (Pt,C7)(P_t,C_7)-free graphs if k=4k = 4 and t9t\ge 9. This is the first systematic study of the complexity of the kk-coloring problem for (Pt,C)(P_t,C_\ell)-free graphs. We almost completely classify the complexity for the cases when k4,4k \geq 4, \ell \geq 4, and identify the last three open cases

    Exhaustive generation of kk-critical H\mathcal H-free graphs

    Full text link
    We describe an algorithm for generating all kk-critical H\mathcal H-free graphs, based on a method of Ho\`{a}ng et al. Using this algorithm, we prove that there are only finitely many 44-critical (P7,Ck)(P_7,C_k)-free graphs, for both k=4k=4 and k=5k=5. We also show that there are only finitely many 44-critical graphs (P8,C4)(P_8,C_4)-free graphs. For each case of these cases we also give the complete lists of critical graphs and vertex-critical graphs. These results generalize previous work by Hell and Huang, and yield certifying algorithms for the 33-colorability problem in the respective classes. Moreover, we prove that for every tt, the class of 4-critical planar PtP_t-free graphs is finite. We also determine all 27 4-critical planar (P7,C6)(P_7,C_6)-free graphs. We also prove that every P10P_{10}-free graph of girth at least five is 3-colorable, and determine the smallest 4-chromatic P12P_{12}-free graph of girth five. Moreover, we show that every P13P_{13}-free graph of girth at least six and every P16P_{16}-free graph of girth at least seven is 3-colorable. This strengthens results of Golovach et al.Comment: 17 pages, improved girth results. arXiv admin note: text overlap with arXiv:1504.0697

    List coloring in the absence of a linear forest.

    Get PDF
    The k-Coloring problem is to decide whether a graph can be colored with at most k colors such that no two adjacent vertices receive the same color. The Listk-Coloring problem requires in addition that every vertex u must receive a color from some given set L(u)⊆{1,…,k}. Let Pn denote the path on n vertices, and G+H and rH the disjoint union of two graphs G and H and r copies of H, respectively. For any two fixed integers k and r, we show that Listk-Coloring can be solved in polynomial time for graphs with no induced rP1+P5, hereby extending the result of Hoàng, Kamiński, Lozin, Sawada and Shu for graphs with no induced P5. Our result is tight; we prove that for any graph H that is a supergraph of P1+P5 with at least 5 edges, already List 5-Coloring is NP-complete for graphs with no induced H

    Parameterized Complexity of Maximum Edge Colorable Subgraph

    Full text link
    A graph HH is {\em pp-edge colorable} if there is a coloring ψ:E(H){1,2,,p}\psi: E(H) \rightarrow \{1,2,\dots,p\}, such that for distinct uv,vwE(H)uv, vw \in E(H), we have ψ(uv)ψ(vw)\psi(uv) \neq \psi(vw). The {\sc Maximum Edge-Colorable Subgraph} problem takes as input a graph GG and integers ll and pp, and the objective is to find a subgraph HH of GG and a pp-edge-coloring of HH, such that E(H)l|E(H)| \geq l. We study the above problem from the viewpoint of Parameterized Complexity. We obtain \FPT\ algorithms when parameterized by: (1)(1) the vertex cover number of GG, by using {\sc Integer Linear Programming}, and (2)(2) ll, a randomized algorithm via a reduction to \textsc{Rainbow Matching}, and a deterministic algorithm by using color coding, and divide and color. With respect to the parameters p+kp+k, where kk is one of the following: (1)(1) the solution size, ll, (2)(2) the vertex cover number of GG, and (3)(3) l - {\mm}(G), where {\mm}(G) is the size of a maximum matching in GG; we show that the (decision version of the) problem admits a kernel with O(kp)\mathcal{O}(k \cdot p) vertices. Furthermore, we show that there is no kernel of size O(k1ϵf(p))\mathcal{O}(k^{1-\epsilon} \cdot f(p)), for any ϵ>0\epsilon > 0 and computable function ff, unless \NP \subseteq \CONPpoly

    Resonant scattering of spin waves from a region of inhomogeneous magnetic field in a ferromagnetic film

    Full text link
    The transmission of a dipole-dominated spin wave in a ferromagnetic film through a localised inhomogeneity in the form of a magnetic field produced by a dc current through a wire placed on the film surface was studied experimentally and theoretically. It was shown that the amplitude and phase of the transmitted wave can be simultaneously affected by the current induced field, a feature that will be relevant for logic based on spin wave transport. The direction of the current creates either a barrier or well for spin wave transmission. The main observation is that the current dependence of the amplitude of the spin wave transmitted through the well inhomogeneity is non-monotonic. The dependence has a minimum and an additional maximum. A theory was constructed to clarify the nature of the maximum. It shows that the transmission of spin waves through the inhomogeneity can be considered as a scattering process and that the additional maximum is a scattering resonance
    corecore