jarvist

[Fri06Jul-12:34]jarvist@nmscde005688:~/.local/lib/python3.5/site-packages/sumo/ 
> python3 -m unittest discover tests
............/home/jarvist/.local/lib/python3.5/site-packages/monty/dev.py:214: UserWarning: Cannot install excepthook, IPyhon.core.ultratb not available
  "Cannot install excepthook, IPyhon.core.ultratb not available")
.................................................EEEEEEEEE.E...EEFF.Froot
  +--sub1
  +--sub2
  |  +--sub2sub1
  +--sub3
     +--sub3sub1

jarvist

# poster_split.sh
# Script to split (Google Docs 'Drawing') poster into 4 panels for printing @ A3

# mutool is part of mupdf-tools on debian
# Lovely fast built in poster command!
mutool poster -x2 -y2 "${1}" 2x2.pdf

# For tweeter.
# -background white -alpha remove - puts in white background, removes ugly black transparent regions
# -density 144 -resize 50% - super-sample @ 200% to add anti-aliasing (avoid jagged text)

jarvist

Keybase proof

I hereby claim:

• I am jarvist on github.
• I am jarvist (https://keybase.io/jarvist) on keybase.
• I have a public key ASCjCstG9VXZQyQ-ZAyC71SKt-LDRCdDB7rDQ1ojV2y2SAo

To claim this, I am signing this object:

jarvist

# Physics Constants for electronic structure + stat physics
# defined as const to help with type stability
# 2016-07 - Updated accuracy from https://github.com/DataWookie/PhysicalConstants.jl
const c = 2.99792458e8;                            # m / s  # speed of light in this universe
#const G = 6.673e-11;                              # m^3 / kg s^2 
const h= 6.62606896e-34;                           # kg m^2 / s 
const hbar = const ħ = 1.05457162825e-34;          # kg m^2 / s 

const eV = const q = const ElectronVolt = 1.602176487e-19;                         # kg m^2 / s^2 
const MassElectron = 9.10938188e-31;                          # kg

jarvist

#!/bin/sh
# delta_SCF_extract_values.sh - extract values from Delta-SCF Gaussian calculations

for i in *neutral.log
do
    # Kohn-Sham HOMO/LUMO from the 'neutral' Gaussian calculation
    HOMO=` grep "occ" "${i}" | tail -n 1 | awk '{print $NF*27.2114}' `
    LUMO=` grep "virt" "${i}" | head -n 1 | awk '{print $5*27.2114}' `
    KSGAP=` echo "${LUMO} - ${HOMO}" | bc -l `

jarvist

{
 "metadata": {
  "language": "Julia",
  "name": "",
  "signature": "sha256:1a9071938dba4bd8f1ff573acb818698bab505d669c6377b952b615085b22cb0"
 },
 "nbformat": 3,
 "nbformat_minor": 0,
 "worksheets": [
  {

jarvist

        for (i=0;i<256;i++)
        {
            // Alright, this is the plan
            // First we take our variable
            // Then we bit reverse it as binary
            // Pretty confusing, but means it will fill in the temperature
            // range with maximum coverage, rather than linear ramping
            unsigned char r=i;
            r=(r&0xF0)>>4 | (r&0x0F)<<4;
            r=(r&0xCC)>>2 | (r&0x33)<<2;

jarvist

%%
%% This is file `advancedmaterials.bst',
%% generated with the docstrip utility.
%%
%% The original source files were:
%%
%% merlin.mbs  (with options: `seq-no,nm-init,ed-au,dt-jnl,xmth,dtbf,jtit-x,thtit-x,vol-it,vnum-cm,volp-blk,jpg-1,num-xser,jnm-x,bkpg-x,isbn,issn,ppx,xedn,xand,etal-xc,url,url-blk,nfss,')
%% ----------------------------------------
%% *** Advanced Materials - Jarvist Moore Frost May 2010 ***
%% 

jarvist

# On Fedora, required sudo yum install libgomp lapack lapack-devel blas blas-devel tcsh
# LibXC compiled & installed by hand. There's also a version in the distribution repository.
#
# usage: flags.py [gcc|cray|intel] [dbg|opt] [mpi] [cuda] [elpa] [ls++] > flags.mk
#        scons -Y path/to/lm-x.xxy [-j nprocs] [build_target]
#
# default args: gcc opt
#
#
# the following is produced by:

jarvist

# Requires: https://github.com/speleo3/inkscape-speleo/blob/master/extensions/survex.py by Thomas Holder
from survex import Survex3D

#This is the Oxford Draenen data:
# http://www.oucc.org.uk/DraenenSurvey/
mig=Survex3D('OD2.3d')

for destination in 'wiggly2.1','luck3.19','rifleman.1','pow.44':
    print "OD2 entrance.20 <> ",destination
    length, path = mig.shortestpath('entrance.20',destination)