{ "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" [ [ 1.769072 1.556883 1.447632 ] [ 2.706705 2.541189 3.648112 ] [ 2.031108 4.136433 1.782649 ] [ 3.490046 0.5483522 2.253956 ] [ 3.629143 2.897596 1.184251 ] [ 4.796562 2.667265 3.117649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.769072e-10 1.556883e-10 1.447632e-10 ] [ 2.706705e-10 2.541189e-10 3.648112e-10 ] [ 2.031108e-10 4.136433e-10 1.782649e-10 ] [ 3.490046e-10 5.483522e-11 2.253956e-10 ] [ 3.629143e-10 2.897596e-10 1.184251e-10 ] [ 4.796562e-10 2.667265e-10 3.117649e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4674725 0.647527 -0.9220567 ] [ -2.7256473 0.0212806 1.0466424 ] [ -2.8909243 1.5818661 1.3533274 ] [ 2.2439368 -1.1863277 1.3238968 ] [ 3.6785163 -0.7440783 -3.4454047 ] [ 3.161591 -0.3202678 0.6435948 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.555503372766928e-09 1.037452620736762e-09 -1.477297687791999e-09 ] [ -4.366968380606644e-09 3.409527979659648e-11 1.676905983618002e-09 ] [ -4.631771325962605e-09 2.534428882656075e-09 2.16826952056805e-09 ] [ 3.595183079512766e-09 -1.900706505547436e-09 2.121116501311934e-09 ] [ 5.893632815091719e-09 -1.192144856304609e-09 -5.520146859534438e-09 ] [ 5.065427184731693e-09 -5.131255815550503e-10 1.031152541828452e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.67223627908194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.485747733198668e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6465982 1.7966852 1.4890575 ] [ 2.3307655 2.2217646 3.7777079 ] [ 2.4630602 3.9916183 2.1233749 ] [ 3.6778188 0.7909542 2.3547069 ] [ 3.810113 2.5608082 0.7003753 ] [ 4.4942803 2.9858877 2.9890265 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6465982e-10 1.7966852e-10 1.4890575e-10 ] [ 2.3307655e-10 2.2217646e-10 3.7777079e-10 ] [ 2.4630602e-10 3.9916183e-10 2.1233749e-10 ] [ 3.6778188e-10 7.909542000000001e-11 2.3547069e-10 ] [ 3.810113e-10 2.5608082e-10 7.003753000000001e-11 ] [ 4.4942803e-10 2.9858877e-10 2.9890265e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 -1e-06 -1.1e-06 ] [ 6e-07 -6e-07 2.5e-06 ] [ 7e-07 -8e-07 4e-06 ] [ -1e-06 4.8e-06 4e-06 ] [ 5e-06 7e-07 -5.8e-06 ] [ -4.4e-06 -3e-06 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 -1.6021766208e-15 -1.76239428288e-15 ] [ 9.6130597248e-16 -9.6130597248e-16 4.005441552e-15 ] [ 1.12152363456e-15 -1.28174129664e-15 6.4087064832e-15 ] [ -1.6021766208e-15 7.69044777984e-15 6.4087064832e-15 ] [ 8.010883104e-15 1.12152363456e-15 -9.292624400640001e-15 ] [ -7.04957713152e-15 -4.8065298624e-15 -5.6076181728e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }