{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5063157 -0.7808493 -4.8380743 ] [ -4.7486327 -2.525718 1.2761631 ] [ -3.3078798 3.2638664 0.9841813 ] [ -0.711571 -6.3829709 -1.1849665 ] [ 4.8280672 3.8523001 -2.5766272 ] [ 2.2451417 -0.2949635 4.2614766 ] [ 2.2011903 2.8683351 2.077847 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.112071772839866e-10 -1.251058492828045e-09 -7.751449533153325e-09 ] [ -7.60814829270638e-09 -4.046646330333734e-09 2.044638683147653e-09 ] [ -5.29980767997658e-09 5.229290439494661e-09 1.576832269488551e-09 ] [ -1.140062420239277e-09 -1.022664674722673e-08 -1.898525622731204e-09 ] [ 7.735416391491317e-09 6.172065156525502e-09 -4.128211860357365e-09 ] [ 3.597113542123168e-09 -4.725836236893407e-10 6.827638178606273e-09 ] [ 3.526695636591738e-09 4.595579437840031e-09 3.329077884999418e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.18943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273397300847815e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8884898 2.0169347 0.7620843 ] [ 1.7771152 0.8319225 3.883514 ] [ 1.9751962 2.9924103 2.7907394 ] [ 3.8137215 0.2343441 2.3982711 ] [ 5.195935 2.3092258 1.6946054 ] [ 4.084567 1.1242072 4.8160289 ] [ 4.2315661 3.2782302 3.7026198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8884898e-10 2.0169347e-10 7.620843000000001e-11 ] [ 1.7771152e-10 8.319225e-11 3.883514e-10 ] [ 1.9751962e-10 2.9924103e-10 2.7907394e-10 ] [ 3.8137215e-10 2.343441e-11 2.3982711e-10 ] [ 5.195935e-10 2.3092258e-10 1.6946054e-10 ] [ 4.084567e-10 1.1242072e-10 4.8160289e-10 ] [ 4.231566100000001e-10 3.2782302e-10 3.7026198e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.5e-06 1.1e-06 -3.3e-06 ] [ 2.24e-05 -1.7e-06 -3.2e-06 ] [ -2.7e-06 -4.5e-06 1.5e-06 ] [ -1.31e-05 1.01e-05 -2.1e-06 ] [ 6.6e-06 -2.9e-06 -2e-06 ] [ -1.03e-05 5.9e-06 9.2e-06 ] [ -4e-07 -8.1e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.005441552e-15 1.76239428288e-15 -5.28718284864e-15 ] [ 3.588875630592e-14 -2.72370025536e-15 -5.126965186560001e-15 ] [ -4.32587687616e-15 -7.2097947936e-15 2.4032649312e-15 ] [ -2.098851373248e-14 1.618198387008e-14 -3.36457090368e-15 ] [ 1.057436569728e-14 -4.646312200320001e-15 -3.2043532416e-15 ] [ -1.650241919424e-14 9.45284206272e-15 1.474002491136e-14 ] [ -6.408706483200001e-16 -1.297763062848e-14 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586648724181e-18 } }