{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9782679 -5.3363799 -9.9943979 ] [ -9.5226691 -4.8030449 7.7909949 ] [ -8.6923329 13.581816 -4.3554126 ] [ 5.1628036 -1.8323992 -3.406769 ] [ 8.8399188 -14.1545066 6.837831 ] [ 5.4130466 7.3974487 -4.1446561 ] [ 5.777501 5.1470658 7.2724097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.118041768305911e-08 -8.549823115487042e-09 -1.601279065435261e-08 ] [ -1.525699779963458e-08 -7.695326247432674e-09 1.248254988155203e-08 ] [ -1.392665255259067e-08 2.176046806320737e-08 -6.978140241657743e-09 ] [ 8.271723225702076e-09 -2.935827158212623e-09 -5.458245644266195e-09 ] [ 1.416311123113039e-08 -2.26780195534793e-08 1.095541296518149e-08 ] [ 8.67265670982093e-09 1.185201936070735e-08 -6.640471104676106e-09 ] [ 9.256577028848623e-09 8.246508490479249e-09 1.165168479821914e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.5256788 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.444406904210199e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9489424 2.4942201 1.8911097 ] [ 1.8936024 1.6859267 4.1299048 ] [ 2.1418016 4.8626108 2.0399651 ] [ 4.3754808 2.3264878 1.9243245 ] [ 4.2611419 1.8623519 4.3094553 ] [ 4.4829242 4.7009011 2.4419859 ] [ 4.7294758 4.1554656 4.7464028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9489424e-10 2.4942201e-10 1.8911097e-10 ] [ 1.8936024e-10 1.6859267e-10 4.129904800000001e-10 ] [ 2.1418016e-10 4.8626108e-10 2.0399651e-10 ] [ 4.3754808e-10 2.3264878e-10 1.9243245e-10 ] [ 4.2611419e-10 1.8623519e-10 4.3094553e-10 ] [ 4.4829242e-10 4.700901100000001e-10 2.4419859e-10 ] [ 4.729475800000001e-10 4.155465600000001e-10 4.7464028e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.84e-05 2.45e-05 -2.59e-05 ] [ -6.7e-06 -7.6e-06 7.5e-06 ] [ 1.31e-05 -1.87e-05 3e-06 ] [ -3.6e-06 1.62e-05 1.39e-05 ] [ 3.87e-05 1.34e-05 1.38e-05 ] [ 4.9e-06 -1.56e-05 -6e-07 ] [ -1.8e-05 -1.23e-05 -1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.550181603071999e-14 3.92533272096e-14 -4.149637447872e-14 ] [ -1.073458335936e-14 -1.217654231808e-14 1.2016324656e-14 ] [ 2.098851373248e-14 -2.996070280896e-14 4.8065298624e-15 ] [ -5.76783583488e-15 2.595526125696e-14 2.227025502912e-14 ] [ 6.200423522496e-14 2.146916671872e-14 2.211003736704e-14 ] [ 7.850665441919999e-15 -2.499395528448e-14 -9.6130597248e-16 ] [ -2.88391791744e-14 -1.970677243584e-14 -1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }