{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.2546535 -15.8528935 0.8724586 ] [ 16.5118119 29.0212099 -11.6173708 ] [ 3.0023096 0.8548182 -21.9721195 ] [ -40.7536053 -29.3780444 23.5213677 ] [ 19.2857622 -32.239416 -12.2479838 ] [ 16.4350215 37.8427829 -4.7379921 ] [ 1.7733535 9.751543 26.1816398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.604282581690489e-08 -2.539913533773229e-08 1.397832771535899e-09 ] [ 2.645483899322723e-08 4.64971040091095e-08 -1.861307989092459e-08 ] [ 4.8102302495234e-09 1.369569735074339e-09 -3.520321617232379e-08 ] [ -6.529447362497096e-08 -4.706881590250437e-08 3.768538541818027e-08 ] [ 3.089919731114837e-08 -5.165323858344545e-08 -1.962343329629714e-08 ] [ 2.633180720964535e-08 6.063082202839003e-08 -7.591100172155094e-09 ] [ 2.841225518113853e-09 1.56236942113259e-08 4.194761118176679e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.717107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.678375800281202e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8109286 0.8920233 3.8532527 ] [ 2.0768036 5.6245461 2.1105083 ] [ 2.7547544 2.991607 0.8683284 ] [ 0.5925676 3.3563917 3.0421181 ] [ 4.3103986 1.6132981 2.7657159 ] [ 4.5324725 4.5436557 2.9774796 ] [ 2.9684017 3.391715 5.0137919 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8109286e-10 8.920233e-11 3.8532527e-10 ] [ 2.0768036e-10 5.6245461e-10 2.1105083e-10 ] [ 2.7547544e-10 2.991607e-10 8.683284e-11 ] [ 5.925676e-11 3.3563917e-10 3.0421181e-10 ] [ 4.3103986e-10 1.6132981e-10 2.7657159e-10 ] [ 4.5324725e-10 4.543655700000001e-10 2.9774796e-10 ] [ 2.9684017e-10 3.391715e-10 5.0137919e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.14e-05 3.78e-05 1.22e-05 ] [ 2.62e-05 1.19e-05 2.18e-05 ] [ -1e-06 5.17e-05 1.47e-05 ] [ -7.25e-05 -5.85e-05 -7.5e-06 ] [ 6.41e-05 -5.9e-05 -4.76e-05 ] [ 2.23e-05 -4.78e-05 -3.86e-05 ] [ -6.04e-05 6.39e-05 4.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.428657968511999e-14 6.056227626623999e-14 1.954655477376e-14 ] [ 4.197702746496e-14 1.906590178752e-14 3.492745033344e-14 ] [ -1.6021766208e-15 8.283253129536002e-14 2.355199632576e-14 ] [ -1.16157805008e-13 -9.37273323168e-14 -1.2016324656e-14 ] [ 1.0269952139328e-13 -9.45284206272e-14 -7.626360715008e-14 ] [ 3.572853864384e-14 -7.658404247424001e-14 -6.184401756288e-14 ] [ -9.677146789632e-14 1.0237908606912e-13 7.225816559807999e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.661456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.989894851328789e-18 } }