{ "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" [ [ -0.028842700000000006 0.08188630000000001 0.08531850000000002 ] [ -0.14273320000000003 -0.052558500000000015 -0.011700700000000001 ] [ 0.07461790000000001 -0.10298540000000003 0.09590550000000003 ] [ -0.14667810000000003 -0.08099910000000002 0.24737480000000006 ] [ -0.007976800000000001 0.14961290000000002 -0.07069270000000001 ] [ 0.09310520000000001 0.06409600000000001 0.08051370000000001 ] [ 0.20868850000000005 0.034932200000000004 -0.16850400000000001 ] [ -0.050180900000000014 -0.09398440000000002 -0.25821500000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.621109962074817e-11 1.311963154238151e-10 1.366953060217248e-10 ] [ -2.286837960519706e-10 -8.420799992431682e-11 -1.874658798699456e-11 ] [ 1.195510548731923e-10 -1.650008001637364e-10 1.536575499061344e-10 ] [ -2.350042226033645e-10 -1.297748643258413e-10 3.96338121135076e-10 ] [ -1.278024246879744e-11 2.397062905500884e-10 -1.132621912012282e-10 ] [ 1.491709747149082e-10 1.026931126867968e-10 1.28997167794105e-10 ] [ 3.343558357298209e-10 5.596755415310977e-11 -2.699731693112832e-10 ] [ -8.039866479070274e-11 -1.505796083999156e-10 -4.137060361398721e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 30.980019 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.96354621537398e-18 } }