{ "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" 3.620000123977662 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.620000123977662e-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" [ 2.4602225870026 2.30901989170764 2.30808563751657 2.32333021739441 2.3679777383915 2.38068298861741 2.36240067127526 2.37762106642012 2.30490030866845 2.31973792683048 2.30551298341713 2.36620396029518 2.30758512341477 2.31306785282465 2.29816237918454 2.32737382971797 2.33407981928894 2.33538116013176 2.34000861174726 2.33224115438392 2.35731923761379 2.34417924756564 2.54614318438652 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.4602225870026003e-10 2.30901989170764e-10 2.30808563751657e-10 2.32333021739441e-10 2.3679777383915004e-10 2.38068298861741e-10 2.36240067127526e-10 2.37762106642012e-10 2.3049003086684498e-10 2.31973792683048e-10 2.3055129834171302e-10 2.36620396029518e-10 2.30758512341477e-10 2.3130678528246504e-10 2.2981623791845398e-10 2.32737382971797e-10 2.33407981928894e-10 2.33538116013176e-10 2.34000861174726e-10 2.33224115438392e-10 2.35731923761379e-10 2.34417924756564e-10 2.54614318438652e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.01365587335484863 0.7166455974083898 0.7462480792824189 0.7692113358713911 0.7857610428036795 0.7822641556648647 0.7940500457526822 0.7241068834082022 0.8037832259151707 0.8074012706219041 0.8297436921769118 0.8321050803450565 0.8091816737934739 0.7712044671218461 0.7799081758882658 0.7323852928608425 0.6979633348315749 0.6445051385587417 0.5823390447832464 0.5335822001419113 0.49360504283681333 0.437791132923918 0.015446385834437788 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.01365587335484863 0.7166455974083898 0.7462480792824189 0.7692113358713911 0.7857610428036795 0.7822641556648647 0.7940500457526822 0.7241068834082022 0.8037832259151707 0.8074012706219041 0.8297436921769118 0.8321050803450565 0.8091816737934739 0.7712044671218461 0.7799081758882658 0.7323852928608425 0.6979633348315749 0.6445051385587417 0.5823390447832464 0.5335822001419113 0.49360504283681333 0.437791132923918 0.015446385834437788 ] } "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 ] } }