kinetic monte carlo simulation was applied to investigation of kinetics and mechanism of oxalic acid degradation by direct and heterogeneous catalytic ozonation. la-containing perovskites including lafeo3, lanio3, lacoo3 and lamno3 was studied as catalyst for oxalic acid ozonation. the reaction kinetic mechanisms of each abovementioned catalytic systems has been achieved. the rate constants val...

monte carlo methods designed base on stochastic reiterations and can be useful in uncertainty conditions. the purpose of this research was investigation of uncertainty to rank desertification indicators. in order to decrease uncertainty have been applied monte carlo reiterations for each value of indicator, if rank of xi is higher than rank of xk constantly. using multi dimension integrals the ...

medicinal chemistry depends on many other disciplines ranging from organic chemistry andpharmacology to computational chemistry. typically medicinal chemists use the moststraightforward ways to prepare compounds. the validation of any design project comes from thebiological testing.studies of the binding site of vinblastine by a single cross—linking experiment identified it asbeing between resi...

in this paper, an interval approach is presented to achieve perfect selectivity and maximum sensitivity in distance relay zones, considering uncertainties. for this purpose, first, the uncertainties affecting the settings of the three zones of a distance relay are discussed. then, by using the monte-carlo simulation, the uncertainties are modelled and the impedances seen by the distance relay a...

background: gold nanoparticles (gnps) have been shown as a good radiosensitizer. in combination with radiotherapy, several studies with orthovoltage x-rays have shown considerable dose enhancement effects. this paper reports the dose enhancement factor (def) due to gnps in 18 megavoltage (mv) beams. materials and methods: different geometrical 50-nm gnps configurations at a concentration of 5 m...

background: exposure conditions in ct examinations are quite different from conventional xray. in ct examination higher dose is given to patient in comparison with the dose in other diagnostic examinations. in order to calculate organ effective dose in chest ct, monte carlo simulation has been used in this study. materials and methods: the impact survey data were used to determine the parameter...

background: two protocols of aapm tg-51 and iaea trs-398 were compared followed by a measurement and monte carlo simulation of beam quality correction factor, kq, aapm tg-51 and iaea trs-398 protocols were compared for the absorbed dose to water for dw, and kq parameters. materials and methods: dose measurements by either protocols were performed with cylindrical and plane parallel chambers for...