Quantum Theory Chemistry

The Quantum Game Library (QGL) for PHP aims to centralise common game elements in a component library. Includes Map Computations for Grid/Hex maps, pluggable map generator, Artificial Intelligence algorithms, plugin system and more. Or it will :).

qsims simulates quantum dynamics with an (almost) arbitrary time-dependent Hamiltonian. qsims uses a Chebychev polynomial expansion of the Schrodinger propagator, and the pseudospectral method developed by R. Kosloff.

The CCP1GUI project aims to develop a free, extensible Graphical User Interface to various computational chemistry codes developed by the worldwide academic community, with an emphasis on ab initio Quantum Chemistry codes.


Platforms: Windows, Mac, Linux

The Chemistry Development Kit (CDK) is a scientific, LGPL-ed library for bio- and cheminformatics and computational chemistry written in Java.


Platforms: Windows, Mac, Linux

Java library offering theory of sets/set theory functionality (complement, intersection, symetric difference, union, cartesian product and powerset). There's also an ant task/ant tasks included that provides the library's functionality


Platforms: Windows, Mac, Linux

LGV Theory Test (UK) uses the Latest Official DSA highway code revision question data bank in an intuitive, powerful way and is one of the most flexible applications on the market. REVISE MULTIPLE TOPICS at the same time! CHOOSE how many times you want to


Platforms: Mac

FREE Lite Version of LGV Theory Test (UK) uses the Latest Official DSA highway code revision question data bank in an intuitive, powerful way and is one of the most flexible applications on the market. REVISE MULTIPLE TOPICS at the same time! CHOOSE how m


Platforms: Mac

In this 3rd tutorial in our series on Music Theory, Master Arranger and Composer Gregg Fine explores the nature of Rhythm and why it’s the driving force in music and composition... Rhythm is at the very essence of being. Our hearts beat. We walk and


Platforms: Mac

PCV Theory Test (UK) uses the Latest Official DSA highway code revision question data bank in an intuitive, powerful way and is one of the most flexible applications on the market. REVISE MULTIPLE TOPICS at the same time! CHOOSE how many times you want to


Platforms: Mac

FREE Lite Version of PCV Theory Test (UK) uses the Latest Official DSA highway code revision question data bank in an intuitive, powerful way and is one of the most flexible applications on the market. REVISE MULTIPLE TOPICS at the same time! CHOOSE how m


Platforms: Mac

The Quantum Game Library (QGL) for PHP aims to centralise common game elements in a component library. It includes Map Computations for Grid/Hex maps, pluggable map generator, Artificial Intelligence algorithms, plugin system and more.


Platforms: Windows, Mac, *nix, PHP, BSD Solaris

Intended for an introductory course in control systems and for the practicing engineer, the goal of this book is to present a unified treatment of conventional and modern continuous control systems, and to show how to apply the theory presented to realistic design problems.For a full book...


Platforms: Matlab

This book is designed for an advanced course and is a companion volume to the introductory text, Modern Control System Theory and Design, 2e. In addition, it can serve as a text for practicing control system engineers who need to learn more advanced control systems techniques in order to perform...


Platforms: Matlab

In semiconductors, it is possible to make actual potential wells by sandwiching a d-deDUwelld-deDt layer of one semiconductor material (such as InGaAs) between two d-deDUbarrierd-deDt layers of another semiconductor material (such as InP). In this structure, the electron has lower energy in the...


Platforms: Matlab

This is a little script that adds several Gaussian or Lorentzian functions with the appropriate full width at half max and height to generate and plot a spectrum. The input is an array containing frequency vs oscillator strength, desired fwhm of the peaks and method for generating the spectrum....


Platforms: Matlab

Functions for Information theory, such as entropy, mutual information, KL divergence, etcThis toolbox contains functions for discrete random variables to compute following quantities:1)Entropy2)Joint entropy3)Conditional entropy4)Relative entropy (KL divergence)5)Mutual information6)Normalized...


Platforms: Matlab

GaAs-GaAlAs Quantum WellIn a type I quantum well, the energy difference d?OCLEg between the larger band gap of the barrier and the smaller band gap of the well material causes a confinement potential both for the electrons in the conduction band and for the holes in the valence band. In a...


Platforms: Matlab

Computing the main parameters of a Water wave, using the small amplitude wave theory.Inputs: d = water deep (m) H = wave height (m) T = wave period (s) z = depth below the SWL (m) anitime = time animation (s)Outputs: k = wave number sigma = Frecuency L = wave length C = wave phase velocity Cg =...


Platforms: Matlab

Techniques from information theory are usual for the selection of variables in time series prediction or pattern recognition. These tasks involve, directly or indirectly, the maximization of the mutual information between input and output data. However, this procedure requires a high...


Platforms: Matlab

An interactive, simple Swing-based demo of Signal Detection Theory in psychology. Built for Cornell University's Department of Psychology at the request of Dr James Cutting.


Platforms: Mac