{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.35419e-10 0.0 0.0 ] "source-value" [ 5.35419 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] "source-value" [ 0.128546 5.3923 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] "source-value" [ 0.0752915 -0.0875116 5.49588 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.82270854220534e-09 8.715174311677746e-10 2.106691624541885e-09 ] [ -9.47903444611684e-10 -1.050029707210042e-10 1.337180933596556e-09 ] [ -4.876549787258822e-10 -2.124402885996518e-09 -3.071459900699434e-09 ] [ 4.182077198566324e-09 -9.92640381523634e-10 1.590475764720636e-09 ] [ -8.78836173971589e-10 3.246706780570848e-10 -1.65697106123136e-11 ] [ 1.594564359239255e-09 -1.507329367025261e-09 -8.144720928018529e-10 ] [ -3.365033131635101e-09 1.658972500266063e-09 -1.88197674041496e-09 ] [ 1.725494713344017e-09 1.874214995775495e-09 7.501301216694835e-10 ] ] "source-value" [ [ -1.1376451999999995 0.5439583999999997 1.3148934999999995 ] [ -0.5916347999999998 -0.06553769999999998 0.8346026999999997 ] [ -0.30437029999999987 -1.3259479999999995 -1.9170544999999994 ] [ 2.6102472999999993 -0.6195573999999998 0.9926968999999997 ] [ -0.5485263999999997 0.20264349999999995 -0.010341999999999997 ] [ 0.9952487999999997 -0.9408009999999997 -0.5083534999999998 ] [ -2.100288499999999 1.0354491999999995 -1.1746374999999996 ] [ 1.0769690999999995 1.1697929999999996 0.46819439999999984 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.783972156716388e-18 "source-value" -36.100715 } }