{ "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" [ 5.45864 0 0 ] "si-unit" "m" "si-value" [ 5.45864e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103818 5.38839 0 ] "si-unit" "m" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.113176 0.0705962 5.39093 ] "si-unit" "m" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000432489 -6.72518e-05 0.0122781 ] [ 1.51992 1.38746 1.2495 ] [ 0.155886 2.80678 2.64329 ] [ 1.56947 4.13166 3.92938 ] [ 2.77407 -0.0290867 2.65575 ] [ 4.2526 1.27774 3.82666 ] [ 2.78396 2.65139 -0.0871139 ] [ 4.18696 3.99308 1.34271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.32489e-14 -6.72518e-15 1.22781e-12 ] [ 1.51992e-10 1.38746e-10 1.2495e-10 ] [ 1.55886e-11 2.80678e-10 2.64329e-10 ] [ 1.56947e-10 4.13166e-10 3.92938e-10 ] [ 2.77407e-10 -2.90867e-12 2.65575e-10 ] [ 4.2526e-10 1.27774e-10 3.82666e-10 ] [ 2.78396e-10 2.65139e-10 -8.71139e-12 ] [ 4.18696e-10 3.99308e-10 1.34271e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4387771000000001 -0.017044900000000005 -0.7651470000000002 ] [ -2.2719855000000004 -1.6626776000000005 1.7557896000000004 ] [ 0.8516261000000003 -1.8997397000000005 0.30668210000000007 ] [ -1.8427448000000004 -1.8374977000000003 2.6864023000000006 ] [ 1.1075434000000002 2.0324095000000004 -2.1311324000000003 ] [ 0.17869370000000004 1.4257684000000002 1.9598525000000004 ] [ 2.0877699000000005 1.4818303000000002 -1.8172902000000004 ] [ -0.5496800000000001 0.4769518000000001 -1.9951569000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.029984113624239e-10 -2.730894028387393e-11 -1.225900634875258e-09 ] [ -3.6401220508966e-09 -2.663903178647855e-09 2.813085048163784e-09 ] [ 1.364455427083083e-09 -3.043718532945606e-09 4.913588906378477e-10 ] [ -2.952402636660773e-09 -2.943995855713773e-09 4.304090959123349e-09 ] [ 1.774480142001343e-09 3.256278984791819e-09 -3.414450507109394e-09 ] [ 2.862988684242491e-10 2.284332797155423e-09 3.140029855716433e-09 ] [ 3.344976123389955e-09 2.374153862653051e-09 -2.911619871648957e-09 ] [ -8.806844449213442e-10 7.641610232084776e-10 -3.196593740007804e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.23473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.805443726700038e-18 } }