{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7101004 1.04806 1.766436 ] [ 2.790903 0.4588509 0.0526971 ] [ 1.743983 2.805282 0.21112 ] [ 2.565367 1.975659 2.481731 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.101003999999999e-11 1.04806e-10 1.766436e-10 ] [ 2.790903e-10 4.588509000000001e-11 5.26971e-12 ] [ 1.743983e-10 2.805282e-10 2.1112e-11 ] [ 2.565367e-10 1.975659e-10 2.481731e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6549609 -1.0976748 -0.7251389 ] [ -0.2932288 0.2619286 0.2227611 ] [ 0.1237815 0.0157659 -0.2671366 ] [ 1.8244082 0.8199803 0.7695144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.651539662318127e-09 -1.758668901801316e-09 -1.161800592412629e-09 ] [ -4.698043279052391e-10 4.196558792388749e-10 3.569026264436909e-10 ] [ 1.983198253875552e-10 2.525975638587072e-11 -4.280000150800013e-10 ] [ 2.92302416483581e-09 1.31375326617657e-09 1.23289798104894e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4023279 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.025766008007556e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2320257 0.3533665 1.9926572 ] [ 1.9235114 0.6236296 -0.2327528 ] [ 2.673161 2.7905552 0.2633376 ] [ 1.9816553 2.5203005 2.488742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2320257e-10 3.533665e-11 1.9926572e-10 ] [ 1.9235114e-10 6.236296000000001e-11 -2.327528e-11 ] [ 2.673161e-10 2.7905552e-10 2.633376e-11 ] [ 1.9816553e-10 2.5203005e-10 2.488742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 8.8e-06 -8e-07 ] [ 5.9e-06 4e-07 -7e-07 ] [ -6.1e-06 -3.5e-06 -3.4e-06 ] [ 1.9e-06 -5.8e-06 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 1.409915426304e-14 -1.28174129664e-15 ] [ 9.45284206272e-15 6.408706483200001e-16 -1.12152363456e-15 ] [ -9.77327738688e-15 -5.6076181728e-15 -5.44740051072e-15 ] [ 3.04413557952e-15 -9.292624400640001e-15 8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4643956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.195928011872239e-18 } }