{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.194843 2.698336 1.615904 ] [ 2.342296 1.479956 3.870973 ] [ 2.299802 3.774539 3.510423 ] [ 4.310954 2.51113 2.445623 ] [ 3.93016 4.43603 0.8578151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.194843e-10 2.698336e-10 1.615904e-10 ] [ 2.342296e-10 1.479956e-10 3.870973000000001e-10 ] [ 2.299802e-10 3.774539e-10 3.510423e-10 ] [ 4.310954e-10 2.51113e-10 2.445623e-10 ] [ 3.93016e-10 4.43603e-10 8.578151e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.5021673 -0.5166605 1.0094728 ] [ 2.238392 6.0193257 -5.4915545 ] [ 3.4597905 -3.3068276 -0.099928 ] [ -7.6704322 3.429521 0.0655517 ] [ -2.5299176 -5.6253585 4.5164579 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.21326719099026e-09 -8.277813739908384e-10 1.617353719493514e-09 ] [ 3.586299330585754e-09 9.644022909520593e-09 -8.798440231749033e-09 ] [ 5.543195451965943e-09 -5.298121869736174e-09 -1.601023053633024e-10 ] [ -1.228938714227151e-08 5.494698366742636e-09 1.050254011936954e-10 ] [ -4.053374831270446e-09 -9.012817872318556e-09 7.236163256207464e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.247419 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.243994135334172e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2316419 2.5412478 1.5433722 ] [ 2.4179615 1.6994362 3.5840712 ] [ 2.6079991 3.8847802 3.2742776 ] [ 4.207192 2.5139663 2.5627931 ] [ 3.6132605 4.2605604 1.3362241 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2316419e-10 2.5412478e-10 1.5433722e-10 ] [ 2.4179615e-10 1.6994362e-10 3.5840712e-10 ] [ 2.6079991e-10 3.8847802e-10 3.2742776e-10 ] [ 4.207192e-10 2.5139663e-10 2.5627931e-10 ] [ 3.6132605e-10 4.2605604e-10 1.3362241e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5e-06 -9.8e-06 -3.45e-05 ] [ 0.0 6.9e-06 -2.1e-06 ] [ -2.32e-05 3.31e-05 5.96e-05 ] [ 1.65e-05 5.9e-06 -2.44e-05 ] [ 4.2e-06 -3.61e-05 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.005441552e-15 -1.570133088384e-14 -5.52750934176e-14 ] [ 0.0 1.105501868352e-14 -3.36457090368e-15 ] [ -3.717049760256e-14 5.303204614848e-14 9.548972659968001e-14 ] [ 2.64359142432e-14 9.45284206272e-15 -3.909310954752e-14 ] [ 6.72914180736e-15 -5.783857601088001e-14 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }