{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.304566 2.573407 2.013286 ] [ 1.594988 1.205897 3.788304 ] [ 4.305804 2.27362 1.126873 ] [ 3.775257 0.6680547 2.70197 ] [ 5.174566 3.086819 3.056932 ] [ 3.543793 4.723705 1.740813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.304566e-10 2.573407e-10 2.013286e-10 ] [ 1.594988e-10 1.205897e-10 3.788304e-10 ] [ 4.305804000000001e-10 2.27362e-10 1.126873e-10 ] [ 3.775257e-10 6.680547000000001e-11 2.70197e-10 ] [ 5.174566e-10 3.086819000000001e-10 3.056932e-10 ] [ 3.543793e-10 4.723705e-10 1.740813e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7776287 0.7613991 0.080241 ] [ 1.1551547 0.0155238 -0.596647 ] [ 1.0750679 0.1265031 -0.9015316 ] [ -0.3206994 0.5966548 0.9248473 ] [ -0.7174523 0.2079639 -0.3814835 ] [ 0.5855579 -1.7080447 0.8745739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.848075167067795e-09 1.219895847168629e-09 1.28560255288794e-10 ] [ 1.85076186899528e-09 2.48718696308892e-11 -9.55933882146198e-10 ] [ 1.722448669343449e-09 2.026803109485654e-10 -1.444412864332634e-09 ] [ -5.138170852178195e-10 9.559463791239431e-10 1.481768734077988e-09 ] [ -1.149485311069558e-09 3.331949012955126e-10 -6.112039499565389e-10 ] [ 9.381671852341085e-10 -2.73658930816754e-09 1.401221867286252e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.810864 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693397349815177e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7557989 2.962991 1.808599 ] [ 1.9612954 1.2326791 3.2926091 ] [ 3.7923513 2.0448966 1.0219525 ] [ 4.2285974 0.9962875 3.0507862 ] [ 5.1992825 3.0665736 3.3094557 ] [ 3.7616486 4.228075 1.9447756 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7557989e-10 2.962991e-10 1.808599e-10 ] [ 1.9612954e-10 1.2326791e-10 3.2926091e-10 ] [ 3.7923513e-10 2.0448966e-10 1.0219525e-10 ] [ 4.2285974e-10 9.962875e-11 3.0507862e-10 ] [ 5.1992825e-10 3.0665736e-10 3.3094557e-10 ] [ 3.7616486e-10 4.228075e-10 1.9447756e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -9e-07 -4.9e-06 ] [ 5.3e-06 8.2e-06 2.6e-06 ] [ 1.07e-05 6.1e-06 2.8e-06 ] [ -3.9e-06 -8e-07 3.2e-06 ] [ -2e-06 -7.1e-06 -1.14e-05 ] [ -9.5e-06 -5.5e-06 7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-16 -1.4419589706e-15 -7.850665506599998e-15 ] [ 8.4915361602e-15 1.31378483988e-14 4.165659248399999e-15 ] [ 1.71432899838e-14 9.773277467399999e-15 4.486094575199999e-15 ] [ -6.248488872599999e-15 -1.2817413072e-15 5.1269652288e-15 ] [ -3.204353268e-15 -1.13754541014e-14 -1.82648136276e-14 ] [ -1.5220678023e-14 -8.811971486999999e-15 1.21765424184e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.48669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.961894275800146e-18 } }