{ "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" [ [ 0.2519361 0.630526 0.2961672 ] [ 1.040527 1.338339 0.9480581 ] [ 1.471162 2.964903 0.310665 ] [ 0.0960364 2.590998 1.829013 ] [ 2.039261 0.0625187 0.2196196 ] [ 2.19391 1.549757 2.906446 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.519361e-11 6.30526e-11 2.961672e-11 ] [ 1.040527e-10 1.338339e-10 9.480581e-11 ] [ 1.471162e-10 2.964903e-10 3.10665e-11 ] [ 9.60364e-12 2.590998e-10 1.829013e-10 ] [ 2.039261e-10 6.25187e-12 2.196196e-11 ] [ 2.19391e-10 1.549757e-10 2.906446e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -101.7015272 -69.9655559 -68.8063987 ] [ 78.5200011 52.9973697 72.4254664 ] [ 9.9330019 28.3665354 -15.8738259 ] [ -19.3786746 16.6581159 19.8427709 ] [ 31.7239037 -27.726565 -10.503425 ] [ 0.9032951 -0.3299 2.9154123 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.629438091794953e-07 -1.120971779242555e-07 -1.102400033585835e-07 ] [ 1.258029100276103e-07 8.491114669723431e-08 1.16038389016616e-07 ] [ 1.591442341854198e-08 4.544819983097558e-08 -2.543267273962952e-08 ] [ -3.10480593862108e-08 2.668924384155675e-08 3.179162362787058e-08 ] [ 5.082729682865062e-08 -4.442285421809156e-08 -1.682834197332624e-08 ] [ 1.447238290903198e-09 -5.285580672019201e-10 4.671005427052756e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 53.97686 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.64804631561947e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0870809 -0.4389043 0.5518319 ] [ 1.3474531 1.4684222 1.3939296 ] [ 1.7472538 3.7164171 0.3023468 ] [ -0.4262058 3.2736843 1.3872519 ] [ 2.086354 0.0037555 -0.5331527 ] [ 2.4250583 1.1136668 3.4077615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.70809e-12 -4.389043000000001e-11 5.518319e-11 ] [ 1.3474531e-10 1.4684222e-10 1.3939296e-10 ] [ 1.7472538e-10 3.7164171e-10 3.023468e-11 ] [ -4.262058e-11 3.2736843e-10 1.3872519e-10 ] [ 2.086354e-10 3.755500000000001e-13 -5.331527000000001e-11 ] [ 2.4250583e-10 1.1136668e-10 3.4077615e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.39e-05 5.8e-06 -3.3e-06 ] [ 3.3e-06 -2.41e-05 -3.1e-05 ] [ -1.79e-05 2.3e-06 -1.54e-05 ] [ 6.2e-06 2.28e-05 1.17e-05 ] [ -1.37e-05 -3.1e-06 -1.05e-05 ] [ -1.8e-06 -3.6e-06 4.85e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.829202123712e-14 9.292624400640001e-15 -5.28718284864e-15 ] [ 5.28718284864e-15 -3.861245656128e-14 -4.96674752448e-14 ] [ -2.867896151232001e-14 3.68500622784e-15 -2.467351996032e-14 ] [ 9.93349504896e-15 3.652962695424e-14 1.874546646336e-14 ] [ -2.194981970496e-14 -4.96674752448e-15 -1.68228545184e-14 ] [ -2.88391791744e-15 -5.76783583488e-15 7.77055661088e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.962994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.916682930157067e-18 } }