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# Questions tagged [monte-carlo]

Questions on Monte Carlo methods, methods that require the repeated generation of (pseudo-, quasi-)random numbers for computing their results.

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### Parallel Mersenne Twister for Monte Carlo

Recently, I came across a comment claiming that almost all researchers doing Monte Carlo methods are doing it wrong. It went on to elaborate that merely choosing different seeds for different ...
72 views

### Use of Metropolis-Hasting algorithm for gathering statistics

I understand how MH work, I'm able to use it to simulate e.g. 2D Ising model. What I don't understand is what you actually take average of. When I run the simulation, it reaches equlibrium after some ...
146 views

### Efficient Quadrature Methods for Indicator Functions?

I am looking to numerically solve many different integrals where the integrand is simply the indicator function for a region (i.e. 1 on the region, 0 outside. This is for measuring areas). The ...
106 views

### Monte Carlo Metropolis method - trial step algorithm

I'm working on a Magnetization simulation and writing an algorithm using the metropolis method. I am using a change in energy and a Boltzmann distribution, but, my question is about the trial step. ...
926 views

### Convergence of Monte Carlo integration

In my research, one of the steps is to choose a numerical method to estimate $\int_a^b f(t)dt$, where $f$ is Lipschitz continuous but not differentiable. For simplicity, I used midpoint rule but the ...
922 views

### How to choose the number of random points in Monte Carlo simulations?

I am struggling with convergence criteria when performing a Monte carlo simulation on a uniform distribution. Any help would be much appreciated ! Say I want to sample uniformly a 1D interval (for ...
544 views

### Variational Monte Carlo: Variational energy is lower than ground state energy

I'm writing a VMC simulation for hydrogen and helium atoms, but in both my codes my variational energy for certain wavefunctions is not only statistically different from my expectation value, but it ...
186 views

### Maxwellian distribution of velocities with Shake algorithm present

I am writing a code to perform hybrid monte carlo molecular dynamics. To do this, I need to have a code to initialize the velocities of all particles according to a maxwell distribution. The code is ...
163 views

### Variational Monte Carlo to calculate local energy of hydrogen like ions in python

I'm writing up a code to calculate the local energy for electrons in hydrogen like ions for a given wavefunction. My code is giving me weird results, which leads me to believe something is wrong. ...
75 views

### Optimal partitioning of a graph

Consider a planar graph, where each node is associated with a weight. I would like to partition the graph such that the sum of the node weights in each group satisfy a minimum requirement. However, I ...
127 views

### Monte Carlo simulation [closed]

I am wondering if I am thinking correctly about the following problem : Define the box of the dimensions $(a,a,H)$ in the $X$,$Y$, and $Z$ directions, respectively. Insert $n$ particles into the box ...
474 views

### Monte Carlo Double Integration Implementation

Am implementing a monte carlo integration routine to compute this double integral in eqn 0.3 of page 2 of this paper 'Mobius energy of knots and unknots', Annals of Mathematics, http://www.math.ucsb....
242 views

### Metropolis Monte Carlo integration of Area with unknown normalization

I probably miss something very basic. I don't see how to use Metropolis–Hastings algorithm for computation of integrals, if I don't know the volume of accessible phase space (i.e. proper normalization ...
907 views

### How to sample points in hyperbolic space?

Hyperbolic space in the Poincaré upper half space model looks like ordinary $\Bbb R^n$ but with the notion of angle and distance distorted in a relatively simple way. In Euclidean space I can sample a ...
76 views

### Monte Carlo sampling of particle system for velocity dependent potential

When sampling configurations of point particles in statistical mechanics by means of (Markov chain) Monte Carlo, we may work with a potential that only depends on the positions of the particles, and ...