{ "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" [ [ 2.079295 2.566064 0.7389026 ] [ 2.731821 0.8253972 1.952601 ] [ 1.402373 2.394344 3.393524 ] [ 2.931703 3.951911 3.265612 ] [ 3.743563 1.858686 3.844421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.079295e-10 2.566064e-10 7.389026e-11 ] [ 2.731821e-10 8.253972000000001e-11 1.952601e-10 ] [ 1.402373e-10 2.394344e-10 3.393524e-10 ] [ 2.931703e-10 3.951911e-10 3.265612e-10 ] [ 3.743563e-10 1.858686e-10 3.844421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3446627 1.4182499 -2.5900894 ] [ 1.1499307 -3.8864245 -1.4623396 ] [ -6.8799398 -0.0138372 2.0536276 ] [ 1.3940297 4.6847988 -0.2561783 ] [ 4.6806421 -2.2027869 2.2549797 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.522105200018041e-10 2.272286832231938e-09 -4.149780682461899e-09 ] [ 1.842392083080179e-09 -6.22673847240433e-09 -2.342926318790023e-09 ] [ -1.102287870007143e-08 -2.216963833733376e-11 3.290274128549614e-09 ] [ 2.233481794040838e-09 7.505875110511895e-09 -4.104428830162887e-10 ] [ 7.499215342952216e-09 -3.529253671784508e-09 3.612875755718597e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.9269477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.291663796044332e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.628511 2.8253999 0.8099202 ] [ 2.4137107 0.7479562 2.1996675 ] [ 0.9170576 2.2364589 3.5552818 ] [ 2.7417895 3.8906034 3.0783591 ] [ 4.1876861 1.8959838 3.5518321 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.628511e-10 2.8253999e-10 8.099202e-11 ] [ 2.4137107e-10 7.479562e-11 2.1996675e-10 ] [ 9.170576000000001e-11 2.2364589e-10 3.5552818e-10 ] [ 2.7417895e-10 3.8906034e-10 3.0783591e-10 ] [ 4.1876861e-10 1.8959838e-10 3.5518321e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.3e-06 -9e-07 -8e-07 ] [ 1.9e-06 3.7e-06 -1.3e-06 ] [ 8e-07 -2.4e-06 1.2e-06 ] [ 1.9e-06 2e-06 -2.3e-06 ] [ -2.3e-06 -2.4e-06 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.68500622784e-15 -1.44195895872e-15 -1.28174129664e-15 ] [ 3.04413557952e-15 5.928053496960001e-15 -2.08282960704e-15 ] [ 1.28174129664e-15 -3.84522388992e-15 1.92261194496e-15 ] [ 3.04413557952e-15 3.2043532416e-15 -3.68500622784e-15 ] [ -3.68500622784e-15 -3.84522388992e-15 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }