{ "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" [ [ 0.0662807 0.8720519 0.0908129 ] [ 1.491471 1.392356 0.9155942 ] [ 0.0089195 1.355999 1.632084 ] [ 2.755779 1.093572 2.625507 ] [ 1.848544 2.519779 2.293479 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.62807e-12 8.720519e-11 9.08129e-12 ] [ 1.491471e-10 1.392356e-10 9.155942e-11 ] [ 8.919500000000001e-13 1.355999e-10 1.632084e-10 ] [ 2.755779e-10 1.093572e-10 2.625507e-10 ] [ 1.848544e-10 2.519779e-10 2.293479e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.4391347 -9.7111132 -23.3226682 ] [ 23.5263062 -1.3617169 -12.4806315 ] [ -16.5593586 4.0714551 25.1502821 ] [ 6.7438095 -10.9937515 4.4224944 ] [ -3.2716223 17.9951265 6.2305231 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.672533755772202e-08 -1.555891853098227e-08 -3.736703372471562e-08 ] [ 3.769329776742209e-08 -2.181710981328252e-09 -1.999617600212003e-08 ] [ -2.653101720436342e-08 6.523190173856925e-09 4.029519398714473e-08 ] [ 1.080477391602894e-08 -1.761393162818493e-08 7.085617133298923e-09 ] [ -5.241716761147924e-09 2.883137096663853e-08 9.982398446174341e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.7304005 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.772407225720631e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0616048 0.7665212 -0.0417127 ] [ 2.061578 1.4998629 0.463834 ] [ 0.1114951 1.2385993 2.2051677 ] [ 2.3665711 0.7450431 2.6743312 ] [ 1.6929547 2.9837315 2.2558569 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.16048e-12 7.665212000000001e-11 -4.17127e-12 ] [ 2.061578e-10 1.4998629e-10 4.63834e-11 ] [ 1.114951e-11 1.2385993e-10 2.2051677e-10 ] [ 2.3665711e-10 7.450431e-11 2.6743312e-10 ] [ 1.6929547e-10 2.9837315e-10 2.2558569e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 -8.6e-06 2.39e-05 ] [ -1.63e-05 1.44e-05 -7.2e-06 ] [ -1.98e-05 -2.19e-05 -4.97e-05 ] [ 2.35e-05 -5.07e-05 3.15e-05 ] [ 1.92e-05 6.67e-05 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.073458335936e-14 -1.377871893888e-14 3.829202123712e-14 ] [ -2.611547891904e-14 2.307134333952e-14 -1.153567166976e-14 ] [ -3.172309709184e-14 -3.508766799552e-14 -7.962817805376001e-14 ] [ 3.76511505888e-14 -8.123035467456e-14 5.04685635552e-14 ] [ 3.076179111936e-14 1.0686518060736e-13 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.206918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.23750515980227e-18 } }