{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.45864e-10 0.0 0.0 ] "source-value" [ 5.45864 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.03818e-11 5.388390000000001e-10 0.0 ] "source-value" [ 0.103818 5.38839 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.13176e-11 7.05962e-12 5.39093e-10 ] "source-value" [ 0.113176 0.0705962 5.39093 ] } "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" [ [ 5.065979935665869e-10 -8.240410926695809e-11 -1.02897870858935e-09 ] [ -2.036546089035992e-09 -8.016034101835873e-10 1.201726192932317e-09 ] [ 5.66335309090777e-10 -1.809264517962545e-09 -5.139225042062362e-10 ] [ -1.321528629317313e-09 -1.040088201277978e-09 2.372889264646253e-09 ] [ 8.866161834245319e-10 1.192270627169341e-09 -1.775873875443777e-09 ] [ -1.164417107052058e-10 1.562834533005608e-09 2.549944841704888e-09 ] [ 1.792255490520808e-09 5.200458630332717e-10 -1.372173912953787e-09 ] [ -2.772883873265318e-10 4.582090552651854e-10 -1.433610977654984e-09 ] ] "source-value" [ [ 0.3161936000000001 -0.051432600000000016 -0.6422380000000001 ] [ -1.2711121000000003 -0.5003215000000001 0.7500585000000002 ] [ 0.35347870000000003 -1.1292541000000003 -0.32076520000000003 ] [ -0.8248333000000002 -0.6491720000000001 1.4810410000000003 ] [ 0.5533823000000001 0.7441568000000001 -1.1084133000000003 ] [ -0.07267720000000001 0.9754446000000002 1.5915504000000005 ] [ 1.1186379000000002 0.3245871000000001 -0.8564436000000002 ] [ -0.17306980000000002 0.28599160000000007 -0.8947896000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.559152690793567e-18 "source-value" -22.214484 } }