{ "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" 4.032988503575325 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.032988503575325e-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" [ 2.75242295514157 2.55409873520126 2.54895926053051 2.54748664951993 2.54535258942239 2.5434491008188 2.55037536831781 2.53795097427038 2.52490348956862 2.51114923578076 2.50924862639712 2.51174477981218 2.49501540309205 2.50410570329168 2.50285807558656 2.52465185219325 2.52050755531672 2.52258586103569 2.53421746943848 2.53809683350407 2.5363327093901 2.53536490788537 2.80988007257175 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.75242295514157e-10 2.55409873520126e-10 2.5489592605305103e-10 2.54748664951993e-10 2.54535258942239e-10 2.5434491008188e-10 2.55037536831781e-10 2.53795097427038e-10 2.52490348956862e-10 2.51114923578076e-10 2.50924862639712e-10 2.51174477981218e-10 2.4950154030920503e-10 2.50410570329168e-10 2.50285807558656e-10 2.5246518521932504e-10 2.52050755531672e-10 2.52258586103569e-10 2.5342174694384803e-10 2.53809683350407e-10 2.5363327093900997e-10 2.53536490788537e-10 2.80988007257175e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.00905916985071003 0.7694177189257954 0.8230435664784225 0.884485531863327 0.9526102446303467 1.0315337523740435 1.0632477314558617 1.0476705344285315 1.0960081618940887 1.0822552420610139 1.0973832801598558 1.0531069063604919 0.975016833225717 0.919760595196051 0.9025563991571895 0.8320664189693413 0.7553937359876128 0.6819065299246226 0.5873150662439903 0.5194342255836257 0.46861312669398575 0.40824734417756936 0.010249280687112745 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.00905916985071003 0.7694177189257954 0.8230435664784225 0.884485531863327 0.9526102446303467 1.0315337523740435 1.0632477314558617 1.0476705344285315 1.0960081618940887 1.0822552420610139 1.0973832801598558 1.0531069063604919 0.975016833225717 0.919760595196051 0.9025563991571895 0.8320664189693413 0.7553937359876128 0.6819065299246226 0.5873150662439903 0.5194342255836257 0.46861312669398575 0.40824734417756936 0.010249280687112745 ] } "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" [ "Al" "Al" "Al" "Al" ] } "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 ] } }