{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5863348 -0.066162 1.2361563 ] [ 0.7809896 -8.5219062 2.5240451 ] [ -1.2331663 6.6360372 -2.7129864 ] [ -5.7505478 -12.6421922 -12.6437513 ] [ 5.0704454 8.6026788 11.9549719 ] [ 0.5459442 5.9915445 -0.3584356 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.394119162610632e-10 -1.06003210458708e-10 1.980540739831894e-09 ] [ 1.251283288517006e-09 -1.365359899077973e-08 4.043966082382193e-09 ] [ -1.975750231696234e-09 1.063210374419478e-08 -4.346683418439777e-09 ] [ -9.213393317860104e-09 -2.025502494537705e-08 -2.025752289896712e-08 ] [ 8.123749143852783e-09 1.378301096316716e-08 1.915397663830659e-08 ] [ 8.746990407078226e-10 9.599512599471212e-09 -5.742771431137703e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.211643919227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.155432738011466e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2123307 0.4303873 0.8808877 ] [ 0.574091 0.6989918 3.2386077 ] [ 0.1629993 2.6611099 1.918402 ] [ 2.4470071 -0.1181424 0.7606704 ] [ 2.8023581 0.9736423 2.7540256 ] [ 2.3739151 3.1872863 2.2980055 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.123307e-11 4.303873e-11 8.808877e-11 ] [ 5.74091e-11 6.989918e-11 3.2386077e-10 ] [ 1.629993e-11 2.6611099e-10 1.918402e-10 ] [ 2.4470071e-10 -1.181424e-11 7.606704e-11 ] [ 2.8023581e-10 9.736423e-11 2.7540256e-10 ] [ 2.3739151e-10 3.1872863e-10 2.2980055e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 3.8e-06 1.45e-05 ] [ 1.84e-05 1.1e-06 -2.09e-05 ] [ 7.1e-06 -1.3e-05 -1.03e-05 ] [ -1.81e-05 3.25e-05 5.1e-06 ] [ -5.2e-06 -2.5e-06 2.3e-05 ] [ -2.9e-06 -2.19e-05 -1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1215236438e-15 6.088271209199999e-15 2.3231561193e-14 ] [ 2.94800500656e-14 1.7623942974e-15 -3.34854916506e-14 ] [ 1.13754541014e-14 -2.082829624199999e-14 -1.65024193302e-14 ] [ -2.899939707539999e-14 5.207074060499999e-14 8.1711008334e-15 ] [ -8.331318496799998e-15 -4.005441585e-15 3.6850062582e-14 ] [ -4.6463122386e-15 -3.50876682846e-14 -1.8425031291e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.065364719227606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.573955196983444e-18 } }