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1 vote
1 answer
135 views

Free Time Dependent Schrodinger Equation with Inhomogeneous Dirichlet boundary

There exists a FFT-based method to solve the poisson equation in inhomogeneous Dirichlet boundary condition using the sine-transform. For example, Which fourier series is needed to solve a 2D poisson ...
WhatsupAndThanks's user avatar
0 votes
1 answer
1k views

Who can explain the minimum image convention in molecular dynamic simulations?

How to choose the cutoff radius so that the atoms do not interact with its periodic image? Especially when simulating macromolecules (proteins).
Muhriddin Mahkamov's user avatar
1 vote
0 answers
177 views

Integrating a wavelike equation with absorbing boundary conditions

I am trying to numerically solve the following equation: $\frac{\partial^{2} \phi}{\partial t^{2}}-\frac{\partial^{2} \phi}{\partial x^{2}}+V(x) \phi(x, t)=0$ On some domain, with: $\phi(x, 0) = I(x)$ ...
Joel's user avatar
  • 111
0 votes
0 answers
319 views

COMSOL Circularl polarization

I'm having some problems trying to implement circularly polarized light in COMSOL Muliphysics. For a isotropic homogenous media, I've obtained without problems the TE and TM reflectance curves. ...
Antonio Ganfornina Andrades's user avatar
0 votes
0 answers
242 views

Applying boundary Conditions on FEM

I have a partial differential equatons as shown below. $$\dfrac{d}{dx}((1+x)\dfrac{du(x)}{dx})=0$$ With the following boundary conditions. $$u(0)=0, u(3)=10$$ To solve it using FEM, I multiplied the ...
Aldrich Taylor's user avatar
0 votes
1 answer
110 views

Applying weak form

I have two dimensional equation and I want to solve it using Finite Element Methods. $$ \nabla . (\alpha(x,y)\nabla u(x,y)) + \dfrac{\partial u(x,y)}{\partial x}+\dfrac{\partial u(x,y)}{\partial y}+u(...
Aldrich Taylor's user avatar
3 votes
2 answers
241 views

Solving a Boundary Value Question $\frac{d^2y}{dx^2}=y\cos(x)+\frac{\sin(x)}{x^2+2}$ using Python

I'm looking to solve this boundary value question using the shooting method! $$\frac{d^2y}{dx^2}=y\cos(x)+\frac{\sin(x)}{x^2+2}$$ given the initial values: $$y'(x=-1)=-1\\y'(x=5)=0$$ I'm aware of ...
user avatar
1 vote
0 answers
43 views

How to avoid density getting "deleted" in two way rigid body coupling with LBM CFD?

I've been reading this paper recently, which talks about using Lattice Boltzmann methods and two way coupling. Specifically, it outlines fluid solid coupling, and solid fluid coupling, and how simply ...
Krupip's user avatar
  • 161
4 votes
0 answers
215 views

Non-reflecting boundary conditions for compressible Navier-Stokes equations

I have some questions about the implementation of non-reflecting OUTFLOW boundary condition for Navier Stokes equations. Following Poinsot, Lele "Boundary Conditions for Direct Simulations of ...
John Snow's user avatar
  • 139
1 vote
1 answer
1k views

Proper boundary conditions for potential flow around cylinder

I am computing the stationary, incompressible, inviscid and irrotational flow around a circular cylinder using a discretization in general coordinates. I derived a PDE and proper boundary conditions ...
ronalddb89's user avatar
2 votes
0 answers
195 views

Mass conservation in atmospheric continuity equation numerical solution

My phd project is heavily related to numerical modeling of planetary atmospheres. In particular now I am dealing with a particular expression of the continuity equation, involving a thermodynamic flux....
Juanlu's user avatar
  • 21
0 votes
1 answer
269 views

How can an engineering student become a computational scinece expert in a short time [closed]

How can a student with zero computing or programming language knowledge, few engineering mathematics knowledge, understand computational science especially Finite Element Modelling (FEM) from ...
Gideon Ebelebe's user avatar
1 vote
2 answers
157 views

Definition of inflow boundary in CFD

If $w$ is the vector of conservative variables, $f=f(w)$ the flux function, I think have read somewhere (I can not find it anymore) that the inflow boundary $\Sigma$_ is characterized by: $\Sigma_{-}...
Henry's user avatar
  • 113
1 vote
1 answer
614 views

Shooting method - Matlab ODE

I'm trying to solve these equations of hypersonic adiabatic flow over a flat plate. I did all the simplifications and got these equations for the stagnation point flow. $$\left(Cf''\right)' + f f'' = \...
Manuel Faria's user avatar
2 votes
0 answers
343 views

Implementation of no-slip boundary conditions in lattice Boltzmann method fluid simulation

My faculty advisor recommended that I take a look at the lattice Boltzmann method as an introduction to scientific computing and potentially an undergraduate honors thesis topic. I cooked up a some ...
Bryan Chem's user avatar

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