{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0151231 -0.5201591 0.4977022 ] [ 1.1793041 -1.0819534 -0.6730492 ] [ -0.1128419 0.0013548 2.5373427 ] [ -2.5641274 -2.6790338 2.8544019 ] [ 2.2115087 3.3810114 -1.3319992 ] [ -1.0213933 0.5889742 -0.4864371 ] [ 0.2208275 -0.4146102 -1.824362 ] [ 1.1018453 0.7244161 -1.5735992 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.62640649805402e-09 -8.333867491163692e-10 7.974068289607257e-10 ] [ 1.889453457833585e-09 -1.733480442275071e-09 -1.078343692888143e-09 ] [ -1.807926540266515e-10 2.17062888585984e-12 4.065271152897548e-09 ] [ -4.10818497303269e-09 -4.292285320692983e-09 4.5732559905471e-09 ] [ 3.543227535835801e-09 5.416977419738276e-09 -2.134097977164304e-09 ] [ -1.636452465901761e-09 9.436406934943834e-10 -7.793581491097517e-10 ] [ 3.53804657729712e-10 -6.642787691852121e-10 -2.92295014427593e-09 ] [ 1.765350779398362e-09 1.160642539151115e-09 -2.521183848749584e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.112766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.785902939762114e-18 } }