{ "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" [ [ 2.561149 2.354583 1.277193 ] [ 2.183709 4.435975 3.101892 ] [ 4.282438 5.412611 2.58259 ] [ 3.622423 4.256941 0.4406492 ] [ 4.442586 3.119258 2.322412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.561149e-10 2.354583e-10 1.277193e-10 ] [ 2.183709e-10 4.435975e-10 3.101892e-10 ] [ 4.282438e-10 5.412611e-10 2.58259e-10 ] [ 3.622423e-10 4.256941000000001e-10 4.406492e-11 ] [ 4.442586e-10 3.119258e-10 2.322412e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -62.1250092 9.8596038 28.0425478 ] [ -55.443185 -37.7111136 -17.3661331 ] [ 22.6555628 31.5563085 -5.1607334 ] [ -0.9592585 44.1528527 -51.3590704 ] [ 95.8718899 -47.8576514 45.8433891 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.953523730722492e-08 1.579682669871084e-08 4.492911447282648e-08 ] [ -8.882977478968925e-08 -6.041986455425292e-08 -2.782361244652103e-08 ] [ 3.629821304922618e-08 5.055877971745232e-08 -8.268406399661695e-09 ] [ -1.536901542003677e-09 7.074066833756615e-08 -8.22863018609013e-08 ] [ 1.536037005896917e-07 -7.66764101994764e-08 7.344920623425757e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.080906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.178621784248244e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4259985 2.2917471 1.3335305 ] [ 1.788329 4.4468057 3.1807748 ] [ 4.4109808 5.5399679 2.5563546 ] [ 3.504583 4.6135615 -0.0481388 ] [ 4.9624137 2.6872857 2.7022151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4259985e-10 2.2917471e-10 1.3335305e-10 ] [ 1.788329e-10 4.4468057e-10 3.1807748e-10 ] [ 4.4109808e-10 5.5399679e-10 2.5563546e-10 ] [ 3.504583e-10 4.613561500000001e-10 -4.81388e-12 ] [ 4.9624137e-10 2.6872857e-10 2.7022151e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 2.99e-05 1.21e-05 ] [ 1.47e-05 -1.74e-05 9.2e-06 ] [ -2.18e-05 -9e-06 7e-07 ] [ 3.41e-05 -3.16e-05 1.33e-05 ] [ -2.41e-05 2.81e-05 -3.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 4.790508096192e-14 1.938633711168e-14 ] [ 2.355199632576e-14 -2.787787320192e-14 1.474002491136e-14 ] [ -3.492745033344e-14 -1.44195895872e-14 1.12152363456e-15 ] [ 5.463422276928e-14 -5.062878121728e-14 2.130894905664e-14 ] [ -3.861245656128e-14 4.502116304448e-14 -5.655683471424e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }