{ "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" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2210649 2.017099 -5.2471175 ] [ -11.0192678 -4.1371581 22.2976017 ] [ 15.3767039 -7.1903963 -11.1185786 ] [ 0.7123397 8.9776466 -5.3557508 ] [ 0.1512891 0.3328089 -0.5761548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.365068187377546e-09 3.231748886264765e-09 -8.406809054352494e-09 ] [ -1.765481339294858e-08 -6.628458038983835e-09 3.572469643797867e-08 ] [ 2.463619569651667e-08 -1.152028494106005e-08 -1.781392683621243e-08 ] [ 1.14129402281057e-09 1.438377561082954e-08 -8.580858789286806e-09 ] [ 2.423918609988894e-10 5.332186431672426e-10 -9.231017581269431e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8038417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.570748609517484e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9233662 1.8999086 0.0254729 ] [ 1.0317033 1.4950638 2.7656858 ] [ 3.1419237 1.0425814 1.2132496 ] [ 2.0871459 3.6608698 1.6417859 ] [ 4.594827 3.1431694 1.4661137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.233662e-11 1.8999086e-10 2.54729e-12 ] [ 1.0317033e-10 1.4950638e-10 2.7656858e-10 ] [ 3.1419237e-10 1.0425814e-10 1.2132496e-10 ] [ 2.0871459e-10 3.6608698e-10 1.6417859e-10 ] [ 4.594827000000001e-10 3.1431694e-10 1.4661137e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.76e-05 -1.1e-06 1.3e-05 ] [ -8.8e-06 -1.8e-06 -1.05e-05 ] [ 1.46e-05 8.5e-06 2e-07 ] [ 1.11e-05 -5.3e-06 -9e-06 ] [ 7e-07 -3e-07 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.81983087584e-14 -1.7623942974e-15 2.082829624199999e-14 ] [ -1.40991543792e-14 -2.8839179412e-15 -1.6822854657e-14 ] [ 2.33917788564e-14 1.3618501389e-14 3.204353268e-16 ] [ 1.77841606374e-14 -8.4915361602e-15 -1.4419589706e-14 ] [ 1.1215236438e-15 -4.806529901999999e-16 1.02539304576e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.801245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.531638552710933e-18 } }