BSD Ports

science/py-chempy 0.9.0_2 DragonFly

Package useful for solving problems in chemistry

System
DragonFly
Repository
DPorts
Maintainer
[email protected] (as in FreeBSD)
License
BSD3CLAUSE
Categories
python, science
Package size
435.6 KiB, 2774.2 KiB installed

Description

ChemPy is a Python package useful for chemistry (mainly physical/inorganic/analytical chemistry). Currently it includes: * Numerical integration routines for chemical kinetics (ODE solver front-end) * Integrated rate expressions (and convenience fitting routines) * Solver for equilibria (including multiphase systems) * Relations in physical chemistry: * Debye-Huckel expressions * Arrhenius & Eyring equation * Einstein-Smoluchowski equation * Properties (pure python implementations from the literature) * water density as function of temperature * water permittivity as function of temperature and pressure * water diffusivity as function of temperature * water viscosity as function of temperature * sulfuric acid density as function of temperature & weight fraction H2SO4

In the other systems

SystemPortVersion
DragonFlyscience/py-chempy0.9.0_2
FreeBSDscience/py-chempy0.10.2
HardenedBSDscience/py-chempy0.10.1_6
GhostBSDscience/py-chempy0.10.1_6

Install

Binary package:

pkg install py311-chempy

From DPorts:

cd /usr/dports/science/py-chempy && make install clean

Dependencies

Run dependencies 19

No port depends on this one.