ePSprocLogo
latest

Intro:

  • ePSproc Readme
  • Extended installation notes
  • ePSproc base and multijob class intro

Class demos:

  • ePSdata interface demo
  • ePSproc wavefunction plotting tests & demo
  • ePSproc wavefunction plotting tests & demo: CH3I with animation

Function demos:

  • ePSproc demo
  • ePSproc \(\beta_{L,M}\) calculations demo
  • ePSproc X-section demo
  • Matrix element LM plotting routines demo
  • Data stuctures - basic overview and demo

Matlab:

  • ePSproc Matlab demo

Tutorials:

  • ePolyScat basics tutorial
  • ePolyScat advanced usage tutorial
  • Geometric methods summary

Advanced/Special Topics:

  • Degenerate states tutorial and demo

Test Notebooks:

  • ePSproc function defn tests
  • Frame definitions & rotations tests
  • Low-level function tests & benchmarks
  • ePSproc - basic plotting development, XC version
  • hvPlotters function tests

Method Development:

  • Method development for geometric functions
  • Method development for geometric functions pt 2: \(\beta\) parameters with geometric functions.
  • Method development for geometric functions pt 3: \(\beta\) aligned-frame (AF) parameters with geometric functions.
  • ePSproc LF/AF function verification & tests
  • cclib + chemlab for orbital functions
  • Density Matrices notes + demo (ePSproc + PEMtk dev.)
  • Density Matrices

Function ref:

  • epsproc package
ePSproc
  • »
  • Python Module Index

Python Module Index

e
 
e
- epsproc
    epsproc.AFBLM
    epsproc.basicPlotters
    epsproc.calc
    epsproc.calc.density
    epsproc.calc.density_v1
    epsproc.calc.density_v2
    epsproc.classes
    epsproc.classes.base
    epsproc.classes.multiJob
    epsproc.classes.multiJob_v1_131020
    epsproc.efield
    epsproc.efield.efields
    epsproc.geomFunc
    epsproc.geomFunc.afblmGeom
    epsproc.geomFunc.afblmGeom_bk161020
    epsproc.geomFunc.geomCalc
    epsproc.geomFunc.geomUtils
    epsproc.geomFunc.lfblmGeom
    epsproc.geomFunc.mfblmGeom
    epsproc.geomFunc.w3jVecMethods
    epsproc.geomFunc.wNjSympyWrapper
    epsproc.IO
    epsproc.MFBLM
    epsproc.MFPAD
    epsproc.plot
    epsproc.plot.hvPlotters
    epsproc.plot.util
    epsproc.sphCalc
    epsproc.sphPlot
    epsproc.util
    epsproc.util.conversion
    epsproc.util.env
    epsproc.util.listFuncs
    epsproc.util.misc
    epsproc.util.selectors
    epsproc.util.summary
    epsproc.vol
    epsproc.vol.orbPlot
    epsproc.vol.setOptions
    epsproc.vol.wfPlot

© Copyright 2019, Paul Hockett. Revision 1c0b8fd4.

Built with Sphinx using a theme provided by Read the Docs.
Read the Docs v: latest
Versions
latest
stable
v1.3.1
v1.3.0
v1.3.0-dev
v1.2.6
v1.2.5
v1.2.5-dev
v1.2.4
v1.2.0
dev
Downloads
On Read the Docs
Project Home
Builds