{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8119798 -1.2590172 -0.596603 ] [ -0.535383 -2.5632697 2.2661401 ] [ -4.5729244 0.5455231 2.6311947 ] [ -1.1806321 3.5151084 -2.8771776 ] [ 0.3915643 -1.4051994 -5.9389129 ] [ 9.0904739 -4.8512037 6.8275431 ] [ -1.381119 6.0180585 -2.3121845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.90311167292186e-09 -2.017167923025078e-09 -9.558633784991424e-10 ] [ -8.577781257737665e-10 -4.10681078614503e-09 3.630756687677374e-09 ] [ -7.326632562365867e-09 8.740243569263406e-10 4.21563863311287e-09 ] [ -1.891581148386008e-09 5.631824498057695e-09 -4.609746684609454e-09 ] [ 6.273551669999174e-10 -2.251377626242188e-09 -9.515187401347528e-09 ] [ 1.45645447545726e-08 -7.772485150878458e-09 1.093892993232436e-08 ] [ -2.212796572342675e-09 9.641992631306719e-09 -3.704527948876137e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.97716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079170235638093e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1966734 1.3661624 2.4139511 ] [ 1.3225218 1.4978216 4.793507 ] [ 2.2979642 3.7411304 5.5475596 ] [ 1.164641 3.5594236 3.1866733 ] [ 4.2517375 2.6554297 2.0470728 ] [ 4.4381519 2.7069785 4.5890914 ] [ 3.4195431 4.7264308 3.2674659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1966734e-10 1.3661624e-10 2.4139511e-10 ] [ 1.3225218e-10 1.4978216e-10 4.793507e-10 ] [ 2.2979642e-10 3.7411304e-10 5.547559599999999e-10 ] [ 1.164641e-10 3.5594236e-10 3.1866733e-10 ] [ 4.2517375e-10 2.6554297e-10 2.0470728e-10 ] [ 4.438151900000001e-10 2.7069785e-10 4.5890914e-10 ] [ 3.4195431e-10 4.7264308e-10 3.2674659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.94e-05 -2.8e-06 1.13e-05 ] [ 2.01e-05 -3.5e-06 -2.94e-05 ] [ 9.6e-06 1.53e-05 -3e-06 ] [ -5.66e-05 -8e-07 1.23e-05 ] [ 3.19e-05 -1.6e-06 -1.6e-05 ] [ 9e-07 -4.8e-06 2.54e-05 ] [ 1.36e-05 -1.6e-06 -6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.108222644352e-14 -4.48609453824e-15 1.810459581504e-14 ] [ 3.220375007808e-14 -5.6076181728e-15 -4.710399265152e-14 ] [ 1.538089555968e-14 2.451330229824e-14 -4.8065298624e-15 ] [ -9.068319673728001e-14 -1.28174129664e-15 1.970677243584e-14 ] [ 5.110943420352001e-14 -2.56348259328e-15 -2.56348259328e-14 ] [ 1.44195895872e-15 -7.69044777984e-15 4.069528616832e-14 ] [ 2.178960204288e-14 -2.56348259328e-15 -9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.124642 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.743670105196976e-18 } }