{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.7885211 16.2147991 -33.7936783 ] [ 5.1904537 -9.5474104 40.0563284 ] [ 14.2962959 -7.5125046 -6.5414943 ] [ -27.4575536 28.6225303 -30.0757674 ] [ 28.7593251 -27.7774144 30.3546116 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.330688276183598e-08 2.597897224302423e-08 -5.414344174917284e-08 ] [ 8.316023637998845e-09 -1.529663785808859e-08 6.417731340631059e-08 ] [ 2.290519124373e-08 -1.203635933293751e-08 -1.048062931890418e-08 ] [ -4.399185080472258e-08 4.5858349252617e-08 -4.818669177789892e-08 ] [ 4.607751868482971e-08 -4.450432430461513e-08 4.863344943966535e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.020926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.925964675624308e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3322798 1.1982071 1.0198603 ] [ 0.6062996 -0.007542 2.8707609 ] [ 1.7730318 0.0848882 0.7831671 ] [ 1.6900391 2.4763422 0.8269831 ] [ 2.6286193 1.2705888 2.6778801 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.322798e-11 1.1982071e-10 1.0198603e-10 ] [ 6.062996e-11 -7.542000000000001e-13 2.8707609e-10 ] [ 1.7730318e-10 8.48882e-12 7.831671000000001e-11 ] [ 1.6900391e-10 2.4763422e-10 8.269831e-11 ] [ 2.6286193e-10 1.2705888e-10 2.6778801e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.3e-06 7.5e-06 -3.3e-06 ] [ 3.4e-06 -1.4e-06 -1.1e-06 ] [ 4.1e-06 5.1e-06 4.3e-06 ] [ -5.5e-06 -8.9e-06 -2.2e-06 ] [ 2.5e-06 -2.4e-06 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.8893595262e-15 1.2016324755e-14 -5.2871828922e-15 ] [ 5.4474005556e-15 -2.2430472876e-15 -1.7623942974e-15 ] [ 6.568924199399999e-15 8.1711008334e-15 6.8893595262e-15 ] [ -8.811971486999999e-15 -1.42593720426e-14 -3.5247885948e-15 ] [ 4.005441585e-15 -3.845223921599999e-15 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }