{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] "source-value" [ 5.36838 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] "source-value" [ -0.0320632 5.46183 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] "source-value" [ -0.0835799 0.195471 5.46165 ] } "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" [ [ 1.693346238359355e-09 1.344893395283166e-08 1.119067017147328e-09 ] [ 2.088759583148905e-09 -5.261284624870742e-09 2.298356168464299e-09 ] [ 4.578685927332653e-09 3.631931724011069e-09 -2.357014898687366e-09 ] [ 5.859663466377518e-09 9.415456873450254e-10 -1.367431774569777e-08 ] [ -2.031739286803566e-08 -1.227437763125253e-09 2.51795770590594e-09 ] [ 8.386934624980168e-09 3.888811104888864e-10 8.782702851891226e-10 ] [ 2.183886576961636e-09 3.278736374050246e-09 7.530065093568058e-09 ] [ -4.473883709342235e-09 -1.520130646073089e-08 1.687616213892726e-09 ] ] "source-value" [ [ 1.0569036000000003 8.394164400000001 0.6984667000000001 ] [ 1.3037012000000001 -3.283835600000001 1.4345211000000002 ] [ 2.8577910000000006 2.2668735000000004 -1.4711330000000002 ] [ 3.657314300000001 0.5876666000000001 -8.534837900000001 ] [ -12.681119300000004 -0.7661064000000002 1.5715856000000004 ] [ 5.234712900000001 0.24272050000000006 0.5481732000000001 ] [ 1.3630748000000001 2.0464263000000003 4.699897000000001 ] [ -2.7923786000000006 -9.487909300000002 1.0533272000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.844276062399856e-18 "source-value" -17.752575 } }