{ "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" [ [ 2.144626 2.611578 2.318929 ] [ 1.72687 4.93899 1.794824 ] [ 4.392296 1.543553 2.156587 ] [ 3.81892 4.173373 2.152355 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.144626e-10 2.611578e-10 2.318929e-10 ] [ 1.72687e-10 4.93899e-10 1.794824e-10 ] [ 4.392296e-10 1.543553e-10 2.156587e-10 ] [ 3.81892e-10 4.173373e-10 2.152355e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -193.7593218 -59.6951769 23.8050983 ] [ -62.0945973 48.8425146 -16.7921264 ] [ 81.04337 77.0452404 -8.7286198 ] [ 174.8105491 -66.1925782 1.7156479 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.104366554500238e-07 -9.564221680370023e-08 3.813997195210583e-08 ] [ -9.948651207205079e-08 7.825433499320266e-08 -2.690395233159847e-08 ] [ 1.298457926848441e-07 1.234400829127956e-07 -1.398479057541197e-08 ] [ 2.800773748372305e-07 -1.060522012625157e-07 2.748770954904616e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 42.222466 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.764784789772289e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.430308 2.0288181 2.2473104 ] [ 1.7248566 4.8973077 1.9280899 ] [ 4.3164995 1.7364292 2.2831677 ] [ 4.6110479 4.6049389 1.9641269 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.430308e-10 2.0288181e-10 2.2473104e-10 ] [ 1.7248566e-10 4.8973077e-10 1.9280899e-10 ] [ 4.3164995e-10 1.7364292e-10 2.2831677e-10 ] [ 4.6110479e-10 4.6049389e-10 1.9641269e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.11e-05 5e-07 -2.74e-05 ] [ -9e-06 -2.12e-05 2.96e-05 ] [ 9e-06 2.72e-05 2.43e-05 ] [ 3.11e-05 -6.4e-06 -2.65e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.982769290688e-14 8.010883104e-16 -4.389963940992e-14 ] [ -1.44195895872e-14 -3.396614436096001e-14 4.742442797568e-14 ] [ 1.44195895872e-14 4.357920408576e-14 3.893289188544e-14 ] [ 4.982769290688e-14 -1.025393037312e-14 -4.24576804512e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.3275482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.494437965542512e-18 } }