{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.488897 2.770028 3.014921 ] [ 0.2049674 2.791914 3.698619 ] [ 0.8141582 3.850123 1.870554 ] [ 0.3012674 5.24423 3.479153 ] [ 2.657762 5.04937 3.20133 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.488897e-10 2.770028e-10 3.014921e-10 ] [ 2.049674e-11 2.791914e-10 3.698619e-10 ] [ 8.141582e-11 3.850123e-10 1.870554e-10 ] [ 3.012674e-11 5.244230000000001e-10 3.479153e-10 ] [ 2.657762e-10 5.04937e-10 3.20133e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.4199406 -7.3244948 1.8544687 ] [ -5.399865 -6.398362 7.7444518 ] [ -5.1418478 -1.4771396 -19.1107845 ] [ -4.9033845 8.1331531 6.1583307 ] [ 8.0251567 7.0668433 3.3535333 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.188805535704473e-08 -1.173513432773117e-08 2.971186395145369e-09 ] [ -8.651537458476192e-09 -1.025130600781513e-08 1.240797961487248e-08 ] [ -8.238148332871914e-09 -2.366638532777864e-09 -3.061885213104702e-08 ] [ -7.856088008693097e-09 1.303074775020704e-08 9.866733470694898e-09 ] [ 1.285771844299648e-08 1.132233111811712e-08 5.372952650334272e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.4975007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.361449695677163e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6200199 2.7225766 3.1680062 ] [ 0.1991937 2.7191176 3.8065316 ] [ 0.6276384 3.8553205 1.4131203 ] [ 0.3295722 5.3424934 3.6136678 ] [ 2.6906277 5.0661568 3.2632511 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6200199e-10 2.7225766e-10 3.168006200000001e-10 ] [ 1.991937e-11 2.7191176e-10 3.8065316e-10 ] [ 6.276384e-11 3.8553205e-10 1.4131203e-10 ] [ 3.295722e-11 5.3424934e-10 3.6136678e-10 ] [ 2.6906277e-10 5.0661568e-10 3.2632511e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.6063552 0.8401505 1.2631383 ] [ 1.2263685 0.1196785 0.1698799 ] [ -0.6541543 0.0918617 -2.3947952 ] [ 0.7148932 -0.033601 0.9500875 ] [ -0.6807523 -1.0180897 0.0116895 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.714881253405082e-10 1.34606948905343e-09 2.023770653097057e-09 ] [ 1.964858939185565e-09 1.917460947124128e-10 2.721776041238419e-10 ] [ -1.048070725855789e-09 1.471786680869434e-10 -3.83688488104406e-09 ] [ 1.145385171408899e-09 -5.383473663550081e-11 1.52220798021432e-09 ] [ -1.090685419615828e-09 -1.631159515217286e-09 1.87286436088416e-11 ] ] } "relaxed-potential-energy" { "source-value" -10.287272 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.648202669021046e-18 } }