{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7462159 -5.399008 -4.8779133 ] [ -7.7823951 -0.4746929 1.7271247 ] [ -0.7174463 2.1269148 -1.5356171 ] [ 2.5261481 0.3458371 5.2097362 ] [ 4.2274773 3.4009491 -0.5233304 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.797746289849231e-09 -8.650164393112167e-09 -7.815278647549378e-09 ] [ -1.246877148304848e-08 -7.605418664397523e-10 2.767158815546214e-09 ] [ -1.149475688539463e-09 3.407693166993508e-09 -2.460329816120696e-09 ] [ 4.04733542649834e-09 5.540921162252717e-10 8.346917540175433e-09 ] [ 6.773165295022709e-09 5.448921136550801e-09 -8.384677318339123e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.721666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.198453246362626e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2474308 0.5924011 2.2516894 ] [ 1.2997637 2.0453855 3.0097921 ] [ 1.5701079 4.1329716 1.8811625 ] [ 3.2967156 1.8422806 4.5751231 ] [ 3.662062 3.0999092 2.3924189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2474308e-10 5.924011e-11 2.2516894e-10 ] [ 1.2997637e-10 2.0453855e-10 3.0097921e-10 ] [ 1.5701079e-10 4.1329716e-10 1.8811625e-10 ] [ 3.2967156e-10 1.8422806e-10 4.5751231e-10 ] [ 3.662062000000001e-10 3.0999092e-10 2.3924189e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.89e-05 -2.17e-05 -1.53e-05 ] [ -6.07e-05 3.19e-05 3.85e-05 ] [ -6.24e-05 1.73e-05 -5.09e-05 ] [ 1.04e-05 -4.54e-05 2.41e-05 ] [ 8.38e-05 1.8e-05 3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.630290434112001e-14 -3.476723267136e-14 -2.451330229824e-14 ] [ -9.725212088256e-14 5.110943420352001e-14 6.16837999008e-14 ] [ -9.997582113791999e-14 2.771765553984e-14 -8.155078999872e-14 ] [ 1.666263685632e-14 -7.273881858432e-14 3.861245656128e-14 ] [ 1.3426240082304e-13 2.88391791744e-14 5.6076181728e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.499658 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.483318967799569e-18 } }