{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1035.2795366 -300.5708683 -139.6116928 ] [ 4.5618126 0.0753802 -3.0632501 ] [ 45.1475498 147.1170763 -242.6721559 ] [ -246.9099296 -144.1279321 455.7838733 ] [ 1035.541977 309.91051 134.9905453 ] [ 196.9381269 -12.4041661 -205.4273198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.658700669533178e-06 -4.815676180838158e-07 -2.236825901944717e-07 ] [ 7.308829496190862e-09 1.207723941112281e-10 -4.907867693883262e-09 ] [ 7.233434877596372e-08 2.357075401683098e-07 -3.888036547021128e-07 ] [ -3.955933166484939e-07 -2.309184032148699e-07 7.302462659389294e-07 ] [ 1.659121145406411e-06 4.965313736622046e-07 2.162786957087033e-07 ] [ 3.155296626633236e-07 -1.987366492593991e-08 -3.291308490571649e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 338.13075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.417451824235696e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8001146 0.2871764 0.4019896 ] [ 0.2238531 -0.1465157 2.8257688 ] [ 0.8283013 2.7821987 0.8557843 ] [ 0.2517952 2.3473086 3.2792951 ] [ 3.3009305 0.3272917 0.0289091 ] [ 3.3290922 2.821126 0.4823752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.001146e-11 2.871764e-11 4.019896e-11 ] [ 2.238531e-11 -1.465157e-11 2.8257688e-10 ] [ 8.283013000000001e-11 2.7821987e-10 8.557843000000001e-11 ] [ 2.517952e-11 2.3473086e-10 3.2792951e-10 ] [ 3.3009305e-10 3.272917000000001e-11 2.89091e-12 ] [ 3.3290922e-10 2.821126e-10 4.823752e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.55e-05 -2.77e-05 2.12e-05 ] [ -5.96e-05 -1.04e-05 2.47e-05 ] [ 4.21e-05 -1.31e-05 -6.04e-05 ] [ 2.96e-05 -1.8e-06 1.98e-05 ] [ -6.8e-06 5.94e-05 -3.01e-05 ] [ -2.08e-05 -6.4e-06 2.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.48337376224e-14 -4.438029239616e-14 3.396614436096001e-14 ] [ -9.548972659968001e-14 -1.666263685632e-14 3.957376253376001e-14 ] [ 6.745163573568001e-14 -2.098851373248e-14 -9.677146789632e-14 ] [ 4.742442797568e-14 -2.88391791744e-15 3.172309709184e-14 ] [ -1.089480102144e-14 9.516929127552e-14 -4.822551628608e-14 ] [ -3.332527371264e-14 -1.025393037312e-14 3.973398019584e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.800112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.172327653562153e-18 } }