{ "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" 3.9200000464916234 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.920000046491624e-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" [ 2.74085412295076 2.4510705513833 2.41639369997542 2.42805787627108 2.49072650274254 2.47181024999269 2.43317352089 2.56291265744296 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.74085412295076e-10 2.4510705513833e-10 2.41639369997542e-10 2.42805787627108e-10 2.49072650274254e-10 2.47181024999269e-10 2.43317352089e-10 2.56291265744296e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.023181771218936335 0.925615844731 0.9059746762515961 0.9334020185884463 0.8825353538489232 0.8234558328399448 0.8583151187154051 0.8130642891732323 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02318177121893633 0.925615844731 0.9059746762515961 0.9334020185884463 0.8825353538489232 0.8234558328399448 0.8583151187154051 0.8130642891732323 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Pt" "Pt" "Pt" "Pt" ] } "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 ] } }