{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.4675115e-10 2.1110225e-10 3.2212591e-10 ] [ 3.1426382e-10 5.2774126e-10 2.6176709e-10 ] [ 2.4411541e-10 3.4823443e-10 1.3225634e-10 ] [ 4.4625565e-10 2.2218848e-10 1.8422511e-10 ] [ 5.3756749e-10 3.2021659e-10 3.8663405e-10 ] [ 5.2357996e-10 4.5322416e-10 1.9431557e-10 ] [ 3.2479682e-10 3.8784194e-10 4.5147322e-10 ] ] "source-value" [ [ 2.4675115 2.1110225 3.2212591 ] [ 3.1426382 5.2774126 2.6176709 ] [ 2.4411541 3.4823443 1.3225634 ] [ 4.4625565 2.2218848 1.8422511 ] [ 5.3756749 3.2021659 3.8663405 ] [ 5.2357996 4.5322416 1.9431557 ] [ 3.2479682 3.8784194 4.5147322 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.403658164716801e-13 -7.530550553084159e-12 2.76006966465216e-12 ] [ -9.13240673856e-13 6.9878933316192e-12 -8.4338577318912e-13 ] [ -3.181281898260481e-12 -3.9878176091712e-13 1.68597045806784e-12 ] [ 1.41936826836672e-12 -2.03380300244352e-12 -6.574051110466561e-12 ] [ 4.424570956001281e-12 -3.909310954752e-12 1.34759075575488e-12 ] [ 3.4679112957216e-12 4.6431078470784e-13 1.95818026594176e-12 ] [ -5.957853982106881e-12 6.42040237253184e-12 -3.3453447842304e-13 ] ] "source-value" [ [ 0.0004621 -0.0047002 0.0017227 ] [ -0.00057 0.0043615 -0.0005264 ] [ -0.0019856 -0.0002489 0.0010523 ] [ 0.0008859 -0.0012694 -0.0041032 ] [ 0.0027616 -0.00244 0.0008411 ] [ 0.0021645 0.0002898 0.0012222 ] [ -0.0037186 0.0040073 -0.0002088 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.678964259585301e-18 "source-value" -22.962289 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.568800037098052e-09 4.152123385116833e-09 -1.23007798997867e-09 ] [ 3.713348732261952e-10 2.59120024881984e-12 1.840133174262513e-09 ] [ -5.133368766078013e-09 -2.499254216470045e-09 -2.545671195786567e-10 ] [ 3.221722438346092e-10 -9.591954252174202e-10 2.907086833335727e-09 ] [ -2.327502484896906e-09 8.958253344232283e-10 -1.337186060561743e-09 ] [ 3.152309898644216e-09 6.636850025295436e-10 9.817375696190898e-10 ] [ 4.625419817184768e-11 -2.255775440848622e-09 -2.907126567315922e-09 ] ] "source-value" [ [ 2.2274698 2.5915516 -0.7677543 ] [ 0.231769 0.0016173 1.1485208 ] [ -3.2039968 -1.5599118 -0.1588883 ] [ 0.2010841 -0.5986827 1.8144609 ] [ -1.4527128 0.5591302 -0.8346059 ] [ 1.9675171 0.4142396 0.6127524 ] [ 0.0288696 -1.4079443 -1.8144857 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.17579828855813e-18 "source-value" -19.821774 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] } "instance-id" 1 }