{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.190963 1.4513382 4.1911989 ] [ -0.3706867 -0.491928 2.3642489 ] [ 6.222665 -21.6863904 4.6698182 ] [ 95.0517469 11.0792616 38.2987981 ] [ -94.7127622 9.6477186 -49.524064 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.919016178837831e-09 2.325300132913954e-09 6.715040890702677e-09 ] [ -5.939055643815034e-10 -7.881555407169023e-10 3.787944313332118e-09 ] [ 9.969808382070433e-09 -3.474542768842157e-08 7.481873543426338e-09 ] [ 1.522896866493789e-07 1.77509339112472e-08 6.136143892055946e-08 ] [ -1.5174657328823e-07 1.545734918497731e-08 -7.934629750780294e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 19.235067 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.08179746469216e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2302958 0.6445327 2.6452336 ] [ 0.4948362 2.8720309 2.0579691 ] [ 2.8864521 -0.0607824 1.0305496 ] [ 2.8066284 2.2632358 1.6939477 ] [ 1.0350106 1.3091048 0.2935994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2302958e-10 6.445327e-11 2.6452336e-10 ] [ 4.948362e-11 2.8720309e-10 2.0579691e-10 ] [ 2.8864521e-10 -6.07824e-12 1.0305496e-10 ] [ 2.8066284e-10 2.2632358e-10 1.6939477e-10 ] [ 1.0350106e-10 1.3091048e-10 2.935994e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 5.1e-06 -1.16e-05 ] [ 3.9e-06 -8.4e-06 -5e-07 ] [ 2.4e-06 4e-06 7.4e-06 ] [ 1.8e-06 -4.1e-06 -2.7e-06 ] [ -6.3e-06 3.5e-06 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-15 8.17110076608e-15 -1.858524880128e-14 ] [ 6.24848882112e-15 -1.345828361472e-14 -8.010883104e-16 ] [ 3.84522388992e-15 6.4087064832e-15 1.185610699392e-14 ] [ 2.88391791744e-15 -6.568924145279999e-15 -4.32587687616e-15 ] [ -1.009371271104e-14 5.6076181728e-15 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }