do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals
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Updated
Jun 8, 2024 - Python
do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals
A repository for calculating Molecular Integrals, based on O-ohata method (1966) and Macmurchie-Davidson (1971)
A lightweight, parallel python wrapper for the GSL integration library
Calculus Guide
Solutions to the problems of Kaplan - Advanced Calculus 5th Edition
Contains sample implementations in python of the following numerical methods: Euler's Method, Midpoint Euler's Method, Runge Kuttta Method of Order 4, and Composite Simpson's Rule
Function, function graph, domain, range. Increasing and decreasing functions, odd and even functions. Inverse functions. The class of elementary functions. Trigonometric functions, exponential and logarithmic functions. Power laws, logarithms. Limits, rules for calculating limits, standard limits. Continuity, theorems on continuous functions. De…
State of the art software to host integration bees.
a curated collection of algorithms for performing numerical integration of black-box functions and estimating limits of series and sequences with high precision in Java
Integral library multiplexer for electronic structure theory
Simple calculator on Python
This repo contains recipes for solving computational math problems using Python
Tools for evaluating molecular integrals in Python.
Making the Complex Simple
MATLAB is a multi-paradigm numerical computing environment and proprietary programming language developed by MathWorks. This repository contains some of my MATLAB practice projects.
Вычисление собственных определенных интегралов методом Гаусса-Кронрода
Some Operations Research Tools in python
A couple of projects developed in OCTAVE for numerical analysis of Non-linear Equations, solve Defined Integrals, numerical solution of Ordinary and Partial Differential Equations, Interpolation, and Matrix methods.
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