{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9103243 -0.4790599 -0.6251822 ] [ 1.0591984 0.0006661 0.188425 ] [ -0.4259932 0.7787908 -0.2973344 ] [ 0.5315257 -0.1215769 0.5242949 ] [ 0.0865715 -2.8798518 -0.6391511 ] [ -1.4945249 0.0768825 1.9420671 ] [ 2.1535469 2.6241493 -1.0931193 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.060676956822406e-09 -7.675385780663765e-10 -1.001652312832715e-09 ] [ 1.697022927250186e-09 1.0672098559074e-12 3.0189013226145e-10 ] [ -6.825163512828888e-10 1.247760422534167e-09 -4.763822281644096e-10 ] [ 8.515980569104937e-10 -1.947876684141546e-10 8.400130381053666e-10 ] [ 1.38702834470331e-10 -4.614031263342841e-09 -1.024032958015397e-09 ] [ -2.394492873711186e-09 1.23179345063505e-10 3.111534529280141e-09 ] [ 3.450362523403134e-09 4.204350692587456e-09 -1.751370200634436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.701825 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.355492049215705e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1499991 0.339748 1.0937427 ] [ 1.7382014 1.1403735 2.5460497 ] [ 2.3469811 3.4244841 3.0914278 ] [ 2.3653407 0.3033756 4.8580653 ] [ 4.0907913 0.2925817 2.9772356 ] [ 2.9926681 2.5888757 5.4123496 ] [ 4.7100223 2.5781274 3.5403593 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.499991e-11 3.39748e-11 1.0937427e-10 ] [ 1.7382014e-10 1.1403735e-10 2.5460497e-10 ] [ 2.3469811e-10 3.4244841e-10 3.0914278e-10 ] [ 2.3653407e-10 3.033756e-11 4.8580653e-10 ] [ 4.090791300000001e-10 2.925817e-11 2.9772356e-10 ] [ 2.9926681e-10 2.5888757e-10 5.4123496e-10 ] [ 4.7100223e-10 2.5781274e-10 3.5403593e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.06e-05 8.1e-06 -4.32e-05 ] [ 2.2e-06 -2.92e-05 -1.02e-05 ] [ 2.88e-05 5.5e-06 4.09e-05 ] [ 2.33e-05 -8.6e-06 4.1e-05 ] [ -1.43e-05 -1.45e-05 1.25e-05 ] [ 5.2e-06 1.09e-05 -3.31e-05 ] [ -2.46e-05 2.78e-05 -7.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.300483866039999e-14 1.29776307354e-14 -6.92140305888e-14 ] [ 3.5247885948e-15 -4.67835577128e-14 -1.63422016668e-14 ] [ 4.614268705919999e-14 8.811971486999999e-15 6.552902433059999e-14 ] [ 3.733071557219999e-14 -1.37787190524e-14 6.568924199399999e-14 ] [ -2.29111258662e-14 -2.3231561193e-14 2.0027207925e-14 ] [ 8.331318496799998e-15 1.74637253106e-14 -5.303204658539999e-14 ] [ -3.94135451964e-14 4.454051042519999e-14 -1.24969777452e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.983148 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.721000289736383e-18 } }