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1.
2.
We consider the statistical mechanics of the traveling salesman problem (TSP) and develop some representations to study it. In one representation the mean field theory has a simple form and brings out some of the essential features of the problem. It shows that the system has spontaneous symmetry breaking at any nonzero temperature. In general the phase progressively changes as one decreases the temperature. At low temperatures the mean field theory solution is very sensitive to any small perturbations, due to the divergence of some local susceptibilities. This critical region extends down to zero temperature. We perform the quenched average for a nonmetric TSP in the second representation and the resulting problem is more complicated than the infinite-range spin-glass problem, suggesting that the free energy landscape may be more complex. The role played by frustration in this problem appears explicitly through the localization property of a random matrix, which resembles the tight binding matrix of an electron in a random lattice. 相似文献
3.
G. Hirankumar S. Selvasekarapandian M. S. Bhuvaneswari R. Baskaran M. Vijayakumar 《Journal of Solid State Electrochemistry》2006,10(4):193-197
Thick films of pure polyvinyl alcohol and polyvinyl alcohol doped with silver nitrate with different compositions have been
prepared by solution cast technique. The FT-IR spectrum confirms the complexation process. The conductivity of the pure polyvinyl
alcohol is of the order of 10−7 Sm−1 at 90 °C, and its value increases by two orders of magnitude when doped with 20 wt% of AgNO3. The activation energy, calculated from the Arrhenius plot for all compositions of the poly vinyl alcohol doped with silver
nitrate, is between 0.24 and 0.35 eV. The migration energy for the ion in polymer electrolyte has been calculated from the
modulus spectrum, and is in good agreement with the activation energy calculated from the Arrhenius plot. The modulus spectra
indicate the non-Debye nature of the material. 相似文献
4.
Ciprofloxacin-protected gold nanoparticles 总被引:3,自引:0,他引:3
Tom RT Suryanarayanan V Reddy PG Baskaran S Pradeep T 《Langmuir : the ACS journal of surfaces and colloids》2004,20(5):1909-1914
The antibacterial drug ciprofloxacin (cfH) has been used to protect gold nanoparticles of two different mean diameters, 4 and 20 nm. The protection is complete with about 65 and 585 cfH molecules covering 4 and 15 nm particles, respectively. The nature of binding has been investigated by several analytical techniques. The nitrogen atom of the NH moiety of piperazine group binds on the gold surface, as revealed by voltammetric and spectroscopic studies. The cfH-adsorbed particles are stable in the dry state as well as at room temperature, and as a result, redispersion is possible. The rate of release of the drug molecule from the nanoparticles is more in the basic medium than in pure water, and the kinetics depend on the size of the particle; faster desorption is seen in smaller particles. The bound cfH is fluorescent, and this property could be used in biological investigations. This study shows that metal nanoparticles could be useful carriers for cfH and fluoroquinolone molecules. Most of the bound molecules could be released over an extended period of time. 相似文献
5.
Raghuraman K Katti KK Barbour LJ Pillarsetty N Barnes CL Katti KV 《Journal of the American Chemical Society》2003,125(23):6955-6961
Phosphorus functionalized trimeric alanine compounds (l)- and (d)-P(CH(2)NHCH(CH(3))COOH)(3) 2 are prepared in 90% yields by the Mannich reaction of Tris(hydroxymethyl)phosphine 1 with (l)- or (d)- Alanine in aqueous media. The hydration properties of (l)-2 and (d)-2 in water and water-methanol mixtures are described. The crystal structure analysis of (l)-2.4H(2)O, reveals that the alanine molecules pack to form two-dimensional bilayers running parallel to (001). The layered structural motif depicts two closely packed monolayers of 2 each oriented with its phosphorus atoms projected at the center of the bilayer and adjacent monolayers are held together by hydrogen bonds between amine and carboxylate groups. The water bilayers are juxtaposed with the H-bonded alanine trimers leading to 18-membered (H(2)O)(18) water rings. Exposure of aqueous solution of (l)-2 and (d)-2 to methanol vapors resulted in closely packed (l)-2 and (d)-2 solvated with mixed water-methanol (H(2)O)(15)(CH(3)OH)(3) clusters. The O-O distances in the mixed methanol-water clusters of (l)-2.3H(2)O.CH(3)OH and (d)-2.3H(2)O.CH(3)OH (O-O(average) = 2.857 A) are nearly identical to the O-O distance observed in the supramolecular (H(2)O)(18) water structure (O-O(average) = 2.859 A) implying the retention of the hydrogen bonded structure in water despite the accommodation of hydrophobic methanol groups within the supramolecular (H(2)O)(15)(CH(3)OH)(3) framework. The O-O distances in (l)-2.3H(2)O.CH(3)OH and (d)-2.3H(2)O.CH(3)OH and in (H(2)O)(18) are very close to the O-O distance reported for liquid water (2.85 A). 相似文献
6.
K. V. Lohitakshan P. D. Mithapara P. S. Nair S. A. Pai K. Raghuraman A. V. Jadhav H. C. Jain 《Journal of Radioanalytical and Nuclear Chemistry》1994,183(2):359-370
Extraction of trivalent (Pu3+, Am3+, actinides and Eu3+, a representative of lanthanides) and tetravalent (Np4+ and Pu4+) actinides has been studied with dihexyl N,N-di-ethylcarbamoylmethyl phosphonate (DHDECMP) in combination with TBP in benzene from 2M nitric acid. The stoichiometries of the species extracted were found to be M(NO3)3·(3–n) TBP·n DHDECMP (for trivalent ions) and M(NO3)4·(2–n) TBP·n DHDECMP (for tetravalent ions) by the slope ratio method. The extraction constants evaluated (from the distribution data) indicate that for tetravalent ions (with solvation number two) the extraction constant increases when TBP (Kh=0.17) molecules are successively replaced by more basic DHDECMP (Kh=0.34) molecules. However, for trivalent ions (with solvation number three) when TBP molecules are totally replaced by DHDECMP molecules stereochemical factors appear and instead of increase, a substantial decrease in extraction constants is observed for Eu3+ and Am3+, a lesser decrease being observed for Pu3+ (larger ion). 相似文献
7.
V. Sankara Sastry S. Kalavathy B. K. Guha R. Baskaran U. De J. Janaki 《Phase Transitions》2013,86(1-2):97-105
Electrical resistance measurements at low temperatures and high quasihydrostatic pressures on superconducting and non-superconducting varieties of Y0.8Ba1.2Cu2O5 (obtained by annealing in oxygen and air respectively) show striking anomalies in the vicinity of 100K and 40K. Arguments are presented to show that these anomalies as also the occurrence of T 's in the oxide superconductors either in the vicinity of 100K or of 40K are connected with their layered structure containing planes of Cu-O otahedral complexes. 相似文献
8.
9.
Sambath Baskaran Prof. Cong-Qiao Xu Ya-Fei Jiang Yang-Gang Wang Prof. Dr. Jun Li 《Chemphyschem》2021,22(4):378-385
Single-atom catalysts (SACs) have attracted extensive attention owing to their high catalytic activity. The development of efficient SACs is crucial for applications in heterogeneous catalysis. In this article, the geometric configuration, electronic structure, stabilitiy and catalytic performance of phosphorene (Pn) supported single metal atoms (M=Ru, Rh, Pd, Ir, Pt, and Au) have been systematically investigated using density functional theory calculations and ab initio molecular dynamics simulations. The single atoms are found to occupy the hollow site of phosphorene. Among the catalysts studied, Ru-decorated phosphorene is determined to be a potential catalyst by evaluating adsorption energies of gaseous molecules. Various mechanisms including the Eley-Rideal (ER), Langmuir-Hinshelwood (LH) and trimolecular Eley-Rideal (TER) mechanisms are considered to validate the most favourable reaction pathway. Our results reveal that Ru−Pn exhibits outstanding catalytic activity toward CO oxidation reaction via TER mechanism with the corresponding rate-determining energy barrier of 0.44 eV, making it a very promising SAC for CO oxidation under mild conditions. Overall, this work may provide a new avenue for the design and fabrication of two-dimensional materials supported SACs for low-temperature CO oxidation. 相似文献
10.