{ "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" 3.614960119128228 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.614960119128228e-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" [ 2.50801279463565 2.28173439267581 2.28820757023735 2.2956253639209 2.31366185992894 2.35634990853123 2.31979934574265 2.34089142424509 2.28389794721934 2.27634165156398 2.27366672340393 2.3130462306406 2.28488877053856 2.28924560395669 2.289718595042 2.31003522701334 2.30096147955091 2.31517453329612 2.31449170638395 2.30853719569859 2.31213019473606 2.31776673251912 2.52279900776715 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.50801279463565e-10 2.2817343926758099e-10 2.2882075702373503e-10 2.2956253639209e-10 2.3136618599289398e-10 2.35634990853123e-10 2.3197993457426498e-10 2.34089142424509e-10 2.28389794721934e-10 2.2763416515639802e-10 2.2736667234039302e-10 2.3130462306406e-10 2.2848887705385602e-10 2.2892456039566902e-10 2.2897185950419999e-10 2.3100352270133403e-10 2.3009614795509103e-10 2.31517453329612e-10 2.31449170638395e-10 2.30853719569859e-10 2.31213019473606e-10 2.31776673251912e-10 2.52279900776715e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01365503893877252 0.7029236511847687 0.7333079606105188 0.7642250505047111 0.7902140784173031 0.8143462675868984 0.8394085608412263 0.7981384255167486 0.8797834560663632 0.879993156277364 0.9026763273531018 0.862646643891708 0.8233690345915308 0.7744373953142777 0.776372224683368 0.7177329704948533 0.6818844761020048 0.6201046282735899 0.5544937051358734 0.5046267345259371 0.46536623308641883 0.41979683686949165 0.015448913062078327 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01365503893877252 0.7029236511847687 0.7333079606105188 0.7642250505047111 0.7902140784173031 0.8143462675868984 0.8394085608412263 0.7981384255167486 0.8797834560663632 0.879993156277364 0.9026763273531018 0.862646643891708 0.8233690345915308 0.7744373953142777 0.776372224683368 0.7177329704948533 0.6818844761020048 0.6201046282735899 0.5544937051358734 0.5046267345259371 0.46536623308641883 0.41979683686949165 0.015448913062078327 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 1 1 25 9 25 17 53 9 73 7 29 5 1 17 89 13 37 25 41 15 85 113 1 ] } "species" { "source-value" [ "Cu" "Cu" "Cu" "Cu" ] } "tilt-angle" { "source-value" [ 0.0 14.250032697803595 16.26020470831196 18.924644416051233 22.619864948040426 28.072486935852957 31.890791801845708 36.86989764584402 41.112090439166934 43.60281897270362 46.39718102729638 53.13010235415598 59.48976259388444 61.92751306414704 64.01076641616699 67.38013505195957 71.07535558394876 73.73979529168804 77.31961650818018 79.61114218453038 81.20258929000894 82.3718503314193 90.0 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.24870998909352293 0.2837941092083279 0.3302973548292537 0.3947911196997616 0.4899573262537284 0.5565993180102228 0.6435011087932845 0.7175413405411447 0.7610127542247299 0.809783572570167 0.9272952180016124 1.038292228493046 1.0808390005411685 1.117198630687125 1.1760052070951352 1.2404989719656432 1.287002217586569 1.3494818844471055 1.3894765523934065 1.417252544255341 1.4376599992432493 1.570796326794897 ] } "tilt-axis" { "source-value" [ 0 0 1 ] } }