Questions tagged [numerical-analysis]
The numerical-analysis tag has no usage guidance.
7
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Good software/module in python to determine nuclear attraction integral in Slater type orbital basis sets
I am trying to solve a Hamiltonian of one electron and 10 stationary nuclear centers. here, the electron is treated quantum mechanically and nuclear centers are treated classically objects. The ...
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Limit to volume change in a discretized mathematical model?
I have set up a mathematical model describing the diffusion of ozone out of a gas bubble. The bubble is surrounded by a thin gas film. So actually, the model describes the diffusion of ozone through ...
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Data analysis in TCSPC for fluorescene decay (reconvolution with measured IRF)
I am trying to understand the data analysis of fluorescence decay counts measured by TCSPC technique, particularly with reconvolution with measured IRF.
I am able to get the fitted counts (given by ...
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How to define a flame in numerical combustion?
I am running a CFD simulation (computational fluid dynamics) opposed jet case, where a stream of fresh reactants is opposed to a stream of burnt products. I am looking at the effects of stratification ...
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Column Dispersive Mass Balance analytical / numerical solution
Is there any analytical solution for the most common expression of column mass balance:
$\dfrac{\partial C}{\partial t} + \left(\dfrac{1+\varepsilon}{\varepsilon}\right)\dfrac{\partial q} {\partial t} ...
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Calculating the weight of a chemical within a liquid mixture
I want to know the weight of ethylene glycol in a mixture of Shellzone 50/50 Antifreeze. I have taken the mid-range of 40-60% from the safety data sheet(SDS) for the amount of ethylene glycol in the ...
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Chemistry - Solutions
Please give me a few hints as to how I can approach this problem
A mixture of two miscible volatile ideal liquids P and Q (obeying Raoult’s law) is kept in a vessel (molar ratio of P and Q in the ...
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