{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.829231 -2.4208188 -4.4958074 ] [ 1.7678684 0.4459968 6.3660435 ] [ -2.2096055 9.0648011 5.9514923 ] [ 2.1077264 4.3645786 -6.8282344 ] [ -11.8027782 -1.9044529 -1.6929602 ] [ 0.3479683 -8.3268636 -0.8040091 ] [ 4.9595896 -1.2232413 1.5034753 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.737281004642604e-09 -3.878579284553111e-09 -7.203077507899635e-09 ] [ 2.832437419131103e-09 7.145656459116134e-10 1.019952606269581e-08 ] [ -3.540178273291094e-09 1.452341239462212e-08 9.53534182193122e-09 ] [ 3.37694996112295e-09 6.992825792563995e-09 -1.094003751702232e-08 ] [ -1.891013529252791e-08 -3.05126991179476e-09 -2.712421252384892e-09 ] [ 5.575066750395206e-10 -1.334110618451052e-08 -1.288164582930449e-09 ] [ 7.946138505882824e-09 -1.959848612456999e-09 2.408832975610267e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -38.381377 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.149374490351085e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1246539 3.5294629 2.6269053 ] [ 5.009649 1.0830667 2.0789819 ] [ 3.6909423 2.6880842 1.3210968 ] [ 3.4384763 1.9279886 3.385498 ] [ 5.2155769 3.1407934 2.8618034 ] [ 3.8983091 4.7399184 2.1042261 ] [ 3.6463356 3.9812948 4.1646278 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1246539e-10 3.5294629e-10 2.6269053e-10 ] [ 5.009649e-10 1.0830667e-10 2.0789819e-10 ] [ 3.6909423e-10 2.6880842e-10 1.3210968e-10 ] [ 3.4384763e-10 1.9279886e-10 3.385498e-10 ] [ 5.215576900000001e-10 3.1407934e-10 2.8618034e-10 ] [ 3.8983091e-10 4.7399184e-10 2.1042261e-10 ] [ 3.6463356e-10 3.9812948e-10 4.1646278e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.48e-05 -2.33e-05 3.05e-05 ] [ -3.04e-05 -1.15e-05 9.5e-06 ] [ -4.33e-05 3.11e-05 -6.88e-05 ] [ 1.23e-05 -2.7e-05 3.17e-05 ] [ 3.51e-05 0.0001006 2.82e-05 ] [ 8.9e-05 -4.77e-05 9e-07 ] [ -2.79e-05 -2.22e-05 -3.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.575574640383999e-14 -3.733071526464e-14 4.88663869344e-14 ] [ -4.870616927232e-14 -1.84250311392e-14 1.52206778976e-14 ] [ -6.937424768064e-14 4.982769290688e-14 -1.1022975151104e-13 ] [ 1.970677243584e-14 -4.32587687616e-14 5.078899887936e-14 ] [ 5.623639939008e-14 1.6117896805248e-13 4.518138070656001e-14 ] [ 1.425937192512e-13 -7.642382481215999e-14 1.44195895872e-15 ] [ -4.470072772032e-14 -3.556832098176e-14 -5.12696518656e-14 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }