{ "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" [ [ 2.101107 2.382088 1.155059 ] [ 1.870329 4.675053 0.5879216 ] [ 2.558831 4.133121 3.113399 ] [ 4.446179 2.802067 2.809564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.101107e-10 2.382088e-10 1.155059e-10 ] [ 1.870329e-10 4.675053e-10 5.879216e-11 ] [ 2.558831e-10 4.133121e-10 3.113399e-10 ] [ 4.446179e-10 2.802067e-10 2.809564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4612544 -0.5709807 -0.5260905 ] [ -0.0330275 -0.1511582 0.3974263 ] [ 0.8124459 0.4781945 0.3459524 ] [ -1.2406728 0.2439443 -0.2172882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.390110159211316e-10 -9.148119284680186e-10 -8.428898995249825e-10 ] [ -5.291588834347201e-11 -2.421821340822106e-10 6.36747126351047e-10 ] [ 1.301681826644815e-09 7.661520480951458e-10 5.542768471896499e-10 ] [ -1.987776954222474e-09 3.908418542374215e-10 -3.481340740157145e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7969675 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.409429566243742e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6009108 2.2536661 0.7532595 ] [ 1.6205391 4.4444745 1.0423573 ] [ 2.8873125 4.7424985 3.0797123 ] [ 3.8676837 2.5516898 2.7906145 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6009108e-10 2.2536661e-10 7.532595e-11 ] [ 1.6205391e-10 4.4444745e-10 1.0423573e-10 ] [ 2.8873125e-10 4.7424985e-10 3.0797123e-10 ] [ 3.8676837e-10 2.5516898e-10 2.7906145e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 -7e-07 -1e-06 ] [ 8e-07 6e-07 1.3e-06 ] [ -8e-07 -5e-07 -1.1e-06 ] [ 6e-07 5e-07 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 -1.12152363456e-15 -1.6021766208e-15 ] [ 1.28174129664e-15 9.6130597248e-16 2.08282960704e-15 ] [ -1.28174129664e-15 -8.010883104e-16 -1.76239428288e-15 ] [ 9.6130597248e-16 8.010883104e-16 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.363135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.660357261519421e-18 } }