{ "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" [ [ 2.304566 2.573407 2.013286 ] [ 1.594988 1.205897 3.788304 ] [ 4.305804 2.27362 1.126873 ] [ 3.775257 0.6680547 2.70197 ] [ 5.174566 3.086819 3.056932 ] [ 3.543793 4.723705 1.740813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.304566e-10 2.573407e-10 2.013286e-10 ] [ 1.594988e-10 1.205897e-10 3.788304e-10 ] [ 4.305804000000001e-10 2.27362e-10 1.126873e-10 ] [ 3.775257e-10 6.680547000000001e-11 2.70197e-10 ] [ 5.174566e-10 3.086819000000001e-10 3.056932e-10 ] [ 3.543793e-10 4.723705e-10 1.740813e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0408586 1.9062803 0.2749998 ] [ -0.5176961 -0.7592202 1.0416852 ] [ 3.6328797 -0.0700967 -6.1720445 ] [ 0.9870045 -1.1933856 2.3152229 ] [ 0.5512986 0.0408786 2.1759609 ] [ 0.3873718 0.0755435 0.3641756 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.076345797678619e-09 3.05419772935161e-09 4.405982502846759e-10 ] [ -8.294405880993389e-10 -1.2164048544791e-09 1.668963673673372e-09 ] [ 5.820514921518918e-09 -1.123072939352314e-10 -9.888705400437227e-09 ] [ 1.581355534524394e-09 -1.912014507919381e-09 3.709396002320777e-09 ] [ 8.832777279997709e-10 6.549473721103488e-11 3.486273681754927e-09 ] [ 6.206380415172135e-10 1.210340295534048e-10 5.834736321858126e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.984841 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.759965543340529e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7194973 2.8535085 1.7317126 ] [ 1.7953821 1.1935616 3.4282402 ] [ 4.057276 2.0993153 0.9988958 ] [ 4.1373502 0.8505458 3.2361382 ] [ 5.3719613 3.040594 3.0623834 ] [ 3.6175072 4.4939774 1.9708079 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7194973e-10 2.8535085e-10 1.7317126e-10 ] [ 1.7953821e-10 1.1935616e-10 3.4282402e-10 ] [ 4.057276e-10 2.0993153e-10 9.988958000000001e-11 ] [ 4.137350200000001e-10 8.505458e-11 3.2361382e-10 ] [ 5.3719613e-10 3.040594e-10 3.0623834e-10 ] [ 3.6175072e-10 4.4939774e-10 1.9708079e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.7e-06 -5.7e-06 5.03e-05 ] [ -4.14e-05 -2.7e-05 -5.9e-06 ] [ 2.36e-05 7.7e-06 2.23e-05 ] [ 9.5e-06 3.63e-05 -2.8e-05 ] [ -2.68e-05 -4e-06 -7.1e-06 ] [ 2.95e-05 -7.3e-06 -3.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.13240673856e-15 -9.13240673856e-15 8.058948402624e-14 ] [ -6.633011210111999e-14 -4.32587687616e-14 -9.45284206272e-15 ] [ 3.781136825088e-14 1.233675998016e-14 3.572853864384e-14 ] [ 1.52206778976e-14 5.815901133504e-14 -4.48609453824e-14 ] [ -4.293833343744e-14 -6.4087064832e-15 -1.137545400768e-14 ] [ 4.72642103136e-14 -1.169588933184e-14 -5.062878121728e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.047461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250651359579979e-18 } }