{ "property-id" "tag:brunnels@noreply.openkim.org,2016-02-18:property/grain-boundary-symmetric-tilt-energy-relaxed-relation-cubic-crystal" "instance-id" 1 "a" { "source-value" 3.150138288736343 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.150138288736343e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "minimum-atom-separation" { "source-value" [ 2.69167737189832 2.46282046087347 2.45000559410496 2.46584688810485 2.46945799568928 2.4720773096221 2.46616216529399 2.55936858410357 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.69167737189832e-10 2.46282046087347e-10 2.45000559410496e-10 2.46584688810485e-10 2.46945799568928e-10 2.4720773096221e-10 2.46616216529399e-10 2.55936858410357e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.02118366225922895 1.9955900721962754 2.031264158278842 1.990996678803312 2.0471952479357745 1.8392541478200142 1.5951911584134355 0.7238133290355557 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02118366225922895 1.995590072196275 2.031264158278842 1.990996678803312 2.047195247935774 1.839254147820014 1.595191158413436 0.7238133290355557 ] } "short-name" { "source-value" [ "bcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Mo" "Mo" ] } "tilt-angle" { "source-value" [ 0.0 24.43269767945453 27.79577249602797 32.20422750397202 38.21321070173819 46.82644889274107 52.659006983369785 59.99999999999999 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4264310196508597 0.4851277481909706 0.562069803005627 0.6669463445036643 0.8172757101951847 0.9190730526904897 1.047197551196598 ] } "tilt-axis" { "source-value" [ 1 1 1 ] } }