{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5866022 1.3615634 1.187293 ] [ 2.0154853 -1.942653 0.2898979 ] [ -1.1075533 1.8543321 -1.3516736 ] [ 3.54046 -1.7523593 -1.4288559 ] [ 0.5067296 2.0914203 -1.215149 ] [ -2.2221297 -0.9107322 -0.2861639 ] [ 0.8536103 -0.7015713 2.8046516 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.746370192949847e-09 2.181465047216959e-09 1.902253086639494e-09 ] [ 3.229163427226074e-09 -3.112473218926983e-09 4.644676377990163e-10 ] [ -1.774496003549889e-09 2.970967537818967e-09 -2.165619840872571e-09 ] [ 5.672442238877568e-09 -2.807589101701453e-09 -2.289279517472143e-09 ] [ 8.118703181873357e-10 3.350824708926522e-09 -1.946883318588499e-09 ] [ -3.560244253725318e-09 -1.45915383864975e-09 -4.584851102969492e-10 ] [ 1.367634465934074e-09 -1.124041134684263e-09 4.493547223009314e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.663798 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.27201137773338e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6011253 2.3945566 3.5052832 ] [ 2.0025778 4.6366282 3.2446612 ] [ 2.9051563 3.5147624 1.4062302 ] [ 4.7990116 2.2631499 2.3830461 ] [ 4.5713289 2.6508066 4.7458848 ] [ 5.0569307 4.4400379 1.3932074 ] [ 5.8377884 4.1587065 3.5451021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6011253e-10 2.3945566e-10 3.5052832e-10 ] [ 2.0025778e-10 4.6366282e-10 3.2446612e-10 ] [ 2.9051563e-10 3.5147624e-10 1.4062302e-10 ] [ 4.799011600000001e-10 2.2631499e-10 2.3830461e-10 ] [ 4.571328900000001e-10 2.6508066e-10 4.7458848e-10 ] [ 5.0569307e-10 4.4400379e-10 1.3932074e-10 ] [ 5.8377884e-10 4.1587065e-10 3.5451021e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 2.19e-05 -3.8e-06 ] [ 1.22e-05 -2.27e-05 1.33e-05 ] [ -3.43e-05 -1.49e-05 7.5e-06 ] [ 4.7e-06 -1.24e-05 -2.99e-05 ] [ 3.2e-06 3.55e-05 -2.21e-05 ] [ 3.16e-05 -1.3e-06 -2.5e-06 ] [ -1.41e-05 -6.2e-06 3.76e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 3.508766799552e-14 -6.08827115904e-15 ] [ 1.954655477376e-14 -3.636940929216e-14 2.130894905664e-14 ] [ -5.495465809344e-14 -2.387243164992e-14 1.2016324656e-14 ] [ 7.53023011776e-15 -1.986699009792e-14 -4.790508096192e-14 ] [ 5.126965186560001e-15 5.68772700384e-14 -3.540810331968e-14 ] [ 5.062878121728e-14 -2.08282960704e-15 -4.005441552e-15 ] [ -2.259069035328e-14 -9.93349504896e-15 6.024184094208e-14 ] ] } "relaxed-potential-energy" { "source-value" -30.238791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.844788398145745e-18 } }