{ "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" 3.5213917642831802 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.52139176428318e-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" [ 2.42362670727146 2.25922111399663 2.23358659464443 2.24547987641076 2.31425560599747 2.30445933060807 2.19758836916527 2.28515647431621 2.21956847534963 2.23235399634257 2.21404191521047 2.27644192548873 2.21294248307001 2.23051035847342 2.22088327522373 2.24365172333793 2.21713521033256 2.21472107561651 2.22725180504054 2.21630598902933 2.22758427052528 2.26259992639327 2.44519001787498 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.42362670727146e-10 2.25922111399663e-10 2.2335865946444302e-10 2.24547987641076e-10 2.3142556059974704e-10 2.30445933060807e-10 2.19758836916527e-10 2.28515647431621e-10 2.21956847534963e-10 2.23235399634257e-10 2.2140419152104701e-10 2.27644192548873e-10 2.2129424830700102e-10 2.23051035847342e-10 2.2208832752237304e-10 2.24365172333793e-10 2.21713521033256e-10 2.21472107561651e-10 2.22725180504054e-10 2.2163059890293302e-10 2.2275842705252803e-10 2.26259992639327e-10 2.44519001787498e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.018143696551338344 1.2297126360445727 1.2773623103880711 1.3221962257795439 1.3570155619491329 1.3671598765574287 1.3842822684186677 1.2729715384057165 1.377964255392162 1.3678455957541553 1.3757153064157546 1.2067358931919172 1.2746539669147063 1.2376577335988164 1.2384166859010828 1.142075752888555 1.1250283623459307 1.0442991797393242 0.9461542238647533 0.8633548937419154 0.8000396563780784 0.7250172090333611 0.02052193273429507 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.018143696551338344 1.2297126360445727 1.2773623103880711 1.3221962257795439 1.3570155619491329 1.3671598765574287 1.3842822684186677 1.2729715384057165 1.377964255392162 1.3678455957541553 1.3757153064157546 1.2067358931919172 1.2746539669147063 1.2376577335988164 1.2384166859010828 1.142075752888555 1.1250283623459307 1.0442991797393242 0.9461542238647533 0.8633548937419154 0.8000396563780784 0.7250172090333611 0.02052193273429507 ] } "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" [ "Ni" "Ni" "Ni" "Ni" ] } "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 ] } }