Library

feed icon rss

Your email was sent successfully. Check your inbox.

An error occurred while sending the email. Please try again.

Proceed reservation?

Export
  • 1
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 111 (1999), S. 8987-8999 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: Molecular-dynamics simulations of the photoisomerization of cis-stilbene in supercritical argon were performed. The stilbene molecule is represented by ab initio quantum chemistry, while the solvent, the interaction with solvent, and the time evolution were described by classical mechanics. Reaction rate constants are estimated and their dependence on temperature, pressure, and viscosity are investigated. Agreement with available experimental data was obtained. Our simulations strongly suggest a minimum on the excited-state potential-energy surface at a gauche conformation which is very rapidly reached after excitation, which leads to nonequilibrium barrier transitions. Specific solvent effects were identified. Implications on the current opinion on stilbene photoisomerization are discussed. © 1999 American Institute of Physics.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 2
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    The Journal of Chemical Physics 108 (1998), S. 8773-8781 
    ISSN: 1089-7690
    Source: AIP Digital Archive
    Topics: Physics , Chemistry and Pharmacology
    Notes: An interpolation scheme for potential energy surfaces is presented. It employs a regular grid and finite element interpolation. The aim is the reduction of the computational expense for molecular dynamics simulation with a quantum chemical potential energy function. The methods used are described in detail. The feasibility is demonstrated and the efficiency and accuracy are evaluated for the photoisomerization of cis-stilbene in supercritical argon, using an ab initio configuration- interaction treatment for the first electronically excited state of the stilbene molecule and classical force fields for the solvent–solute interactions (quantum mechanical/molecular mechanical molecular dynamics). The number of required quantum chemical calculations of energy and gradients was substantially reduced compared to a simulation not using the interpolation scheme. On the other hand, the impact on the accuracy is insignificant. © 1998 American Institute of Physics.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 3
    Electronic Resource
    Electronic Resource
    College Park, Md. : American Institute of Physics (AIP)
    Journal of Mathematical Physics 40 (1999), S. 6234-6244 
    ISSN: 1089-7658
    Source: AIP Digital Archive
    Topics: Mathematics , Physics
    Notes: We establish the Schlieder and the Borchers property for thermal field theories. In addition, we provide some information on the commutation and localization properties of projection operators. © 1999 American Institute of Physics.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 4
    ISSN: 1365-2427
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Biology
    Notes: 1. Population dynamics and feeding ecology of adult and larval alpine newts (Triturus alpestris, Laurenti) were investigated in a high-altitude karts lake to estimate their feeding pressure on the copepod Arctodiaptomus alpinuf (Imhof). Estimates of population size for reproducing adults ranged from 666 to 864 individuals in the lake during July and August. Total abundance of larvae before the onset of ice cover varied considerably between 4400 and 25400 individuals in different years.2. Arctodiaptomus alpinus was an important prey item for adult and larval alpine newts. During the second half of their aquatic period, adult newts moved to deeper water where the copepod reached its highest densities near the sediment. Adults and larvae exhibited no periodic feeding pattern. The feeding rhythm was more synchronized among the larvae than among the adults.3. Daily food consumption, estimated using the Elliott & Persson (1978) model, reached 4–21 mg dry biomass in adults. The daily ration of larvae was about 7% of body dry weight in the temperature range 6-11°C. Compared to published estimates of daily food consumption in salmonid fishes, the feeding pressure of newts appears low.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 5
    Electronic Resource
    Electronic Resource
    Oxford, UK; Malden, USA : Blackwell Science Inc
    Ground water 43 (2005), S. 0 
    ISSN: 1745-6584
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Energy, Environment Protection, Nuclear Power Engineering , Geosciences
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 6
    Electronic Resource
    Electronic Resource
    Oxford, UK : Blackwell Science Ltd
    European journal of soil science 49 (1998), S. 0 
    ISSN: 1365-2389
    Source: Blackwell Publishing Journal Backfiles 1879-2005
    Topics: Geosciences , Agriculture, Forestry, Horticulture, Fishery, Domestic Science, Nutrition
    Notes: The impact on nitrate leaching of agronomic practices designed to immobilize nitrogen in autumn and winter was investigated over 4 years. Experimental treatments (reducing tillage depth, incorporating harvest residues, reducing fertilizer N by growing unfertilized grass or by spring-sown rather than autumn-sown crops) were compared with a control treatment in which autumn crops were sown after burning harvest residues, mouldboard ploughing and seedbed preparation. Winter cover cropping was also compared with winter fallowing. In the first year, incorporation of harvest residues or reducing tillage depth significantly decreased nitrate leaching compared with the control. Unfertilized grass did not affect leaching in the first winter but significantly decreased it in years 2 and 3. When winter cover crops were grown, nitrate leaching was never less than that under an autumn-sown cereal, and in the subsequent year leaching could be significantly greater. Winter fallowing caused the most nitrate leaching over the year. In the winter following a spring-sown crop, leaching under an autumn-sown crop greatly increased. Summed over 4 years, most leaching occurred with the winter fallow—spring cropping treatment; it was 18% more than where a winter cover crop preceded the spring crop. Reducing tillage depth or incorporating harvest residues did not significantly decrease leaching. Unfertilized grass ley followed by an autumn-sown cereal in the fourth year was the only treatment that significantly decrease leaching. Unfertilized grass ley followed by an autumn-sown cereal in the fourth year was the only treatment that significantly reduced leaching loss compared with the control. Incorporating harvest residues resulted in a balance between annual N inputs and outputs. All other treatments required substantial net annual N mineralization to balance annual inputs and outputs.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 7
    ISSN: 1662-9752
    Source: Scientific.Net: Materials Science & Technology / Trans Tech Publications Archiv 1984-2008
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics
    Notes: The simultaneous effect of raw materials (A, B and C) on physical andtechnological properties of brick compositions was studied. This investigation was carried outusing the statistical design of mixture experiments. Ten mixtures of three raw materials wereselected and used in the experiments design. Those mixtures were processed under conditionssimilar to those found in the ceramics industry. Fired body characterisation results were thenused to iteratively calculate statistically significant and valid regression equations (traceplots), relating linear firing shrinkage, open porosity, fired bending strength and waterabsorption with the proportions of raw materials. The microstructures of some selectedsamples were studied using scanning electron microscopy. Mixtures with high clay B contentswere most adequate to produce, under constant processing conditions, a brick with specifiedproperties. The microstructures are characterized by a low closed porosity and absence ofvitreous phase
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 8
    ISSN: 1662-9752
    Source: Scientific.Net: Materials Science & Technology / Trans Tech Publications Archiv 1984-2008
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics
    Notes: Mixtures of clays are often used in the manufacture of bricks. In industrial practice, it isdesirable to be able to predict, in an expeditious way, what the effects of a change in raw materialsor the proportions thereof might be in the various processing steps towards the final product. Whenthe property of interest is basically determined by the combination of raw materials, an optimisationmethodology specific to the design of mixture experiments can be successfully used. In the presentstudy, fired bending strength and linear firing shrinkage were selected as the properties to model.Ten formulations of three different clays were selected and used in the experiments design. Thoseformulations were wet processed, uniaxially pressed, and then fired at 1000 °C for 2 h.. From theexperimental results, regression models were calculated, relating each technological property withthe proportions of raw materials. The regression models were then used simultaneously to definewhich combination of those three raw materials was most adequate to produce, under constantprocessing conditions, a brick with specified properties
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 9
    Electronic Resource
    Electronic Resource
    Springer
    Diseases of the colon & rectum 40 (1997), S. 47-50 
    ISSN: 1530-0358
    Keywords: Rectal cancer ; Ultrasound ; Three-dimensional ; Image processing ; Computer
    Source: Springer Online Journal Archives 1860-2000
    Topics: Medicine
    Notes: Abstract PURPOSE: This study was designed to evaluate the application of three-dimensional (3D) transrectal ultrasound (TRUS) in diagnostics, staging, and treatment planning of rectal cancer. METHOD: Transversal images, generated during conventional TRUS examination, are recorded by means of a specially designed computer-based system to obtain a 3D array of slices, covering the whole region of interest. Different structures (normal or pathologically affected) are segmented, isolated, and rendered using the tools of the system to produce a realistic spatial view of investigated organs. Dynamic movies are also generated and replayed for better realization of spatial interrelations of studied objects. RESULTS: Nineteen patients (18 with rectal cancer and 1 who was healthy) have been examined. In 15 patients, full 3D TRUS reconstruction was performed. Results are illustrated with several examples from the studied group. CONCLUSION: We consider 3D TRUS a useful add-on to conventional TRUS. It may significantly improve understanding of the interrelation between normal and pathologic structures and help to exact preoperative staging and treatment planning of rectal carcinoma patients.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
  • 10
    ISSN: 1572-882X
    Keywords: solid-state NMR ; cellulose degradation ; magic-angle spinning ; power transformers ; insulation
    Source: Springer Online Journal Archives 1860-2000
    Topics: Agriculture, Forestry, Horticulture, Fishery, Domestic Science, Nutrition , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Abstract A series of laboratory-aged transformer insulating papers were investigated using solid-state NMR spectroscopy. Carbon-13 CPMAS, and proton MAS experiments were carried out along with static proton relaxation (T1, and T1ρ) and free induction decay (FID) measurements. Some proton CRAMPS and proton-carbon-13 correlation (WISE) experiments were also undertaken. A change in the proton T1 and FID with ageing was detected. No detectable change was found in the proton T1ρ. Some amorphous cellulose was detected in the carbon-13 spectrum. There was, however, no evidence for a substantial change in the nature of the cellulose with ageing. The carbon-13 spectra from some aged samples showed signals not present in the spectrum from an unaged sample. This was taken to be evidence of chemical degradation. Proton MAS and the WISE exeriment gave some information about the nature of the water in the sample.
    Type of Medium: Electronic Resource
    Library Location Call Number Volume/Issue/Year Availability
    BibTip Others were also interested in ...
Close ⊗
This website uses cookies and the analysis tool Matomo. More information can be found here...