{ "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" 4.050004702806472 "source-unit" "angstrom" "si-unit" "m" "si-value" 4.050004702806472e-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" [ 2.8284994386056 2.5910384117146 2.58961304872321 2.59030446091601 2.58358364273854 2.57326674130575 2.55992351220962 2.58844350363588 2.58098889000077 2.56803691769566 2.57557499293024 2.5848532477074 2.56843487742667 2.55104540750184 2.5627653058302 2.60218078560977 2.58844885037496 2.59503063775803 2.5813553280272 2.58632660350957 2.58776044907746 2.58793225252833 2.82842862250851 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.8284994386056e-10 2.5910384117146e-10 2.58961304872321e-10 2.59030446091601e-10 2.58358364273854e-10 2.57326674130575e-10 2.55992351220962e-10 2.58844350363588e-10 2.58098889000077e-10 2.56803691769566e-10 2.57557499293024e-10 2.5848532477074003e-10 2.56843487742667e-10 2.55104540750184e-10 2.5627653058302e-10 2.60218078560977e-10 2.58844885037496e-10 2.59503063775803e-10 2.5813553280272e-10 2.58632660350957e-10 2.58776044907746e-10 2.58793225252833e-10 2.82842862250851e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.010324761809514619 0.4716620512243637 0.48568619823767734 0.49601222756526764 0.49937660947660906 0.5000108039160903 0.5250930538790796 0.47725236959704653 0.5257344592766268 0.5463480670511146 0.5453313451412066 0.5013846476018126 0.5038537684288193 0.47499131277248774 0.48241218444879275 0.44059504575787073 0.43373351793806864 0.3955637513835092 0.3639920452289762 0.3381841981180004 0.3160847547825871 0.28612482361581365 0.011681134539857096 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.010324761809514619 0.4716620512243637 0.48568619823767734 0.49601222756526764 0.49937660947660906 0.5000108039160903 0.5250930538790796 0.47725236959704653 0.5257344592766268 0.5463480670511146 0.5453313451412066 0.5013846476018126 0.5038537684288193 0.47499131277248774 0.48241218444879275 0.44059504575787073 0.43373351793806864 0.3955637513835092 0.3639920452289762 0.3381841981180004 0.3160847547825871 0.28612482361581365 0.011681134539857096 ] } "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 ] } }