Search Results for "open-shell" - Page 28

This software is written in Fortran 90 and is related to forward and inverse problems for the Helmholtz equation in 2-D.

Library of functions used to model simple (one dimensional) liquid crystal cells

software for identifying modules in networks (e.g. "community detection"), as described in "a bayesian approach to network modularity" (physical review letters 100, 258701 (2008); http://link.aps.org/abstract/PRL/v100/e258701).

The Central Library is a mathematics library written in C++.

Collection of scripts converting structure data files into different formats (e.g. CTRL to POSCAR).

Quantum Monte Carlo algorithms expressed in Python. This code calculates electronic properties of atoms and molecules from first principles.

XnaHavok is a C# port of Havok for use within Xna. This is being actively worked on, so check back for new releases.

Elmag Field is an application for simulation of the electromagnetic field in free space.

DVC2D is a physical simulation library capable of simulating and animating planar systems of rigid bodies experiencing intermittent and steady unilateral contacts with friction. One can also include friction between the bodies and the plane of motio

It is a commandline tool to manipulate .xyz molecule files.

This software can simulate heat transfer in solid heterogenous materia using cellular automata. There are two different simulation methods and several test model implemented at the moment. It is also possible to define boundary conditions.

An analytical generalized Born model to calculate electrostatic solvation energy that accurately reproduces the linearized Poisson-Boltzmann equation. More about this method is explained in J. Phys. Chem. B, 111, 3055-3061 (2007).

A Python package extending NumPy and SciPy to allow specification of numbers and arrays with physical units.

Not a whole lab, just a small bench ! **Feel free to contact me via https://sourceforge.net/sendmessage.php?touser=1865508 if you want to take over this project** Mathbench is intended for the development of short scripts such as those daily used when doing research in applied mathematics and physics. Simple widgets and a strong plugin system make it useful and extensible. ANNOUCEMENT: Mathbench's purpose is still relevant and could also benefit from the latest improvements of...

GraXML is a Geometric Modeller for handling High Energy Physics experiments' Detector Description and Event data. It containes full 3D visualisation of the managed elements. It uses Java3D to create, render and manipulate SceneGraph.

a library which i hope to write to compute high precision aerodynamic and electrodynamic equations

The dwi-toolbox provides a set of free and open-source Matlab routines for the simulation and analysis of Diffusion-Weighted Magnetic Resonance Imaging data. It includes data-fitting, simulation, visualization and statistical components.

QMcBeaver is an object-oriented program to perform Quantum Monte Carlo calculations on atoms and molecules. It is designed to be easy to modify, allowing new ideas to be quickly implemented.

Finds the cosmological power spectrum from a N-body simulation using the MPI FFTW library. May be run as a parallel computation for increased resolution. Reads in binary Gadget2 files.

An auxiliary wrapper library to include and use Newton Physics engine with OpenSceneGraph Applications.

SPHear is a coupled smoothed particle hydrodynamics (SPH), finite element (FE) fluid-solid interaction analysis code for dynamic problems.

Class library written in C++ using OpenGL to display results of simulations. Offers quick creation of coordinatesystems, graphs, tables, objcts and fonts.

NLO helps studying the nonlinear optical effects of crystals. It offers a GUI to plot the theoret. expected "maker fringes", captures images from video, retrieves data from and sends data to a LockIn, controls a stepping motor, imports and plots datase

libPunts is a tiny 3D rendering engine focused on developing physics simulations. Gravetat is a gravity and electromagnetism simulator built over libPunts.

JCreme is an automated interface to the CREME96 modeling web app (https://creme96.nrl.navy.mil/). It allows the user to send multiple requests to the CREME96 website and retrieve the results. CREME stands for "Cosmic Ray Effects on Micro Electronics"