{ "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" 3.487144187092781 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.487144187092781e-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" [ 2.44873996916282 2.21267543070361 2.21261831663841 2.23800343908871 2.26267945254591 2.26437348323404 2.24522400610101 2.21696275395985 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 2.44873996916282e-10 2.21267543070361e-10 2.21261831663841e-10 2.23800343908871e-10 2.26267945254591e-10 2.26437348323404e-10 2.24522400610101e-10 2.21696275395985e-10 ] } "relaxed-grain-boundary-energy" { "source-value" [ 0.022681327158123987 1.5475590337129683 1.5653276987464875 1.5909634842733642 1.5278524027027185 1.5210532771888678 1.4995687106392113 1.1833785690629104 ] "source-unit" "J/m^2" "si-unit" "kg / s^2" "si-value" [ 0.02268132715812399 1.547559033712968 1.565327698746487 1.590963484273364 1.527852402702718 1.521053277188868 1.499568710639211 1.18337856906291 ] } "short-name" { "source-value" [ "fcc" ] } "sigma" { "source-value" [ 5 401 311 39 21 113 365 23 ] } "species" { "source-value" [ "Ni" "Ni" "Ni" "Ni" ] } "tilt-angle" { "source-value" [ 0.0 24.43269767945453 27.79577249602797 32.20422750397202 38.21321070173819 46.82644889274107 52.659006983369785 59.99999999999999 ] "source-unit" "degrees" "si-unit" "radian" "si-value" [ 0.0 0.4264310196508597 0.4851277481909706 0.562069803005627 0.6669463445036643 0.8172757101951847 0.9190730526904897 1.047197551196598 ] } "tilt-axis" { "source-value" [ 1 1 1 ] } }