{ "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" [ [ 1.724599 2.153048 2.374712 ] [ 0.8645185 3.613019 0.4039649 ] [ 2.279761 4.306527 2.243044 ] [ 4.11856 1.980977 2.568835 ] [ 3.209467 2.952847 0.6643367 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724599e-10 2.153048e-10 2.374712e-10 ] [ 8.645185e-11 3.613019e-10 4.039649e-11 ] [ 2.279761e-10 4.306527e-10 2.243044e-10 ] [ 4.118560000000001e-10 1.980977e-10 2.568835e-10 ] [ 3.209467e-10 2.952847e-10 6.643367000000001e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3613199 -2.8245625 1.2000501 ] [ -0.2827883 -0.1107668 -0.0007887 ] [ -0.561916 4.1860168 1.1939894 ] [ 0.3849414 -0.8742274 0.5295468 ] [ 1.8210828 -0.3764602 -2.9227977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.181074917209794e-09 -4.5254480014884e-09 1.922692214008702e-09 ] [ -4.530768028957766e-10 -1.774679773208294e-10 -1.26363670082496e-12 ] [ -9.002886780534527e-10 6.70673825123603e-09 1.91298190216302e-09 ] [ 6.167441114580211e-10 -1.40066670154277e-09 8.484275025794534e-10 ] [ 2.917696286701002e-09 -6.031557311016922e-10 -4.682838142268012e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.283046 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.967960913341096e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5774228 2.3205328 2.7905375 ] [ 1.1746355 3.0658499 0.5367933 ] [ 2.1640322 4.5765313 2.1876237 ] [ 3.7242636 1.6331887 2.1328038 ] [ 3.5565513 3.4103153 0.6071343 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5774228e-10 2.3205328e-10 2.7905375e-10 ] [ 1.1746355e-10 3.0658499e-10 5.367933e-11 ] [ 2.1640322e-10 4.5765313e-10 2.1876237e-10 ] [ 3.7242636e-10 1.6331887e-10 2.1328038e-10 ] [ 3.5565513e-10 3.410315300000001e-10 6.071343e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.31e-05 1.12e-05 1.03e-05 ] [ 1.02e-05 6.83e-05 -4e-07 ] [ -3.41e-05 -6.78e-05 -2.11e-05 ] [ 1.22e-05 1.1e-06 2.82e-05 ] [ -1.14e-05 -1.28e-05 -1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.701027994048e-14 1.794437815296e-14 1.650241919424e-14 ] [ 1.634220153216e-14 1.0942866320064e-13 -6.408706483200001e-16 ] [ -5.463422276928e-14 -1.0862757489024e-13 -3.380592669888e-14 ] [ 1.954655477376e-14 1.76239428288e-15 4.518138070656001e-14 ] [ -1.826481347712e-14 -2.050786074624e-14 -2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }