{ "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" 4.031036108732224 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.031036108732225e-10 } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "minimum-atom-separation" { "source-value" [ 2.82368793678429 2.57353743413281 2.5880218578665 2.56538435351479 2.6144508848334 2.56303212680764 2.55336260514607 2.64141054141931 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.82368793678429e-10 2.57353743413281e-10 2.5880218578665e-10 2.565384353514791e-10 2.6144508848334e-10 2.56303212680764e-10 2.55336260514607e-10 2.64141054141931e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.012787863121331022 0.5027701760223526 0.49392652547454347 0.5044776002931565 0.4812311005201726 0.47230788612590513 0.4746978580604746 0.39903102007460645 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01278786312133102 0.5027701760223526 0.4939265254745435 0.5044776002931565 0.4812311005201726 0.4723078861259051 0.4746978580604746 0.3990310200746064 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Al" "Al" "Al" "Al" ] } "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 ] } }