{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3593959 -0.1343179 0.7300621 ] [ -5.4329039 12.4088737 0.6377691 ] [ -11.1822946 -7.0976031 -6.3371501 ] [ 4.6721994 -9.1792321 -2.7523518 ] [ 2.2908953 -1.281234 2.1958825 ] [ 10.9815348 5.5482152 0.9400372 ] [ 0.0299649 -0.2647018 4.5857509 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.177992329391375e-09 -2.152009991349523e-10 1.169688428352152e-09 ] [ -8.704471611633142e-09 1.988120733259999e-08 1.021818741488657e-09 ] [ -1.791601097501809e-08 -1.13716137505376e-08 -1.015323373272038e-08 ] [ 7.485688646395788e-09 -1.470675106751689e-08 -4.409753706176798e-09 ] [ 3.670418890360602e-09 -2.052763160574067e-09 3.518191603523856e-09 ] [ 1.759435831706161e-08 8.889220680607196e-09 1.506105624522294e-09 ] [ 4.800906222460992e-11 -4.240990354436774e-10 7.347182880792559e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.158929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.627639853616712e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6561606 2.115628 3.5982395 ] [ 3.0954329 5.2079037 2.4799631 ] [ 2.5271782 3.0567204 1.4180158 ] [ 4.7253229 1.8867023 1.5410437 ] [ 5.4685571 3.2121423 3.5175866 ] [ 5.6084076 5.4073241 2.2688583 ] [ 3.2922437 3.8190701 4.5042661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6561606e-10 2.115628e-10 3.5982395e-10 ] [ 3.0954329e-10 5.2079037e-10 2.4799631e-10 ] [ 2.5271782e-10 3.0567204e-10 1.4180158e-10 ] [ 4.7253229e-10 1.8867023e-10 1.5410437e-10 ] [ 5.4685571e-10 3.2121423e-10 3.5175866e-10 ] [ 5.6084076e-10 5.4073241e-10 2.2688583e-10 ] [ 3.292243700000001e-10 3.8190701e-10 4.5042661e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-05 -1.06e-05 -1.6e-06 ] [ 8.9e-06 -5.6e-06 -1.12e-05 ] [ -9.3e-06 2e-06 1.5e-06 ] [ -6.2e-06 1.64e-05 -4e-06 ] [ -4.7e-06 1.74e-05 2.57e-05 ] [ 2.9e-06 -8.2e-06 -6.9e-06 ] [ 2.04e-05 -1.14e-05 -3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.92261194496e-14 -1.698307218048e-14 -2.56348259328e-15 ] [ 1.425937192512e-14 -8.972189076479999e-15 -1.794437815296e-14 ] [ -1.490024257344e-14 3.2043532416e-15 2.4032649312e-15 ] [ -9.93349504896e-15 2.627569658112e-14 -6.4087064832e-15 ] [ -7.53023011776e-15 2.787787320192e-14 4.117593915456e-14 ] [ 4.646312200320001e-15 -1.313784829056e-14 -1.105501868352e-14 ] [ 3.268440306432e-14 -1.826481347712e-14 -5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.813779 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.334735010429801e-18 } }