{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9984695 -1.4335992 1.3397062 ] [ -45.0229454 -10.7666019 30.4028098 ] [ -4.6076007 -2.4419658 -0.1967143 ] [ 0.8434279 12.8288825 -19.1281159 ] [ 40.2665212 -5.3076121 -14.2216382 ] [ 5.5221275 7.1208966 1.8039525 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.804077770661663e-09 -2.296879140761093e-09 2.146445970064931e-09 ] [ -7.213471111373779e-08 -1.724999799176e-08 4.871067146950621e-08 ] [ -7.382190180342043e-09 -3.912460545787117e-09 -3.151710550336662e-10 ] [ 1.351320473843689e-09 2.05541357818315e-08 -3.064662034742388e-08 ] [ 6.451407939910563e-08 -8.503732088955672e-09 -2.278557642124182e-08 ] [ 8.847423650468833e-09 1.140893414565004e-08 2.890250544345885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2457449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.802433272704666e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2912681 0.9840463 0.6185615 ] [ 0.8771911 0.2004093 2.6958027 ] [ 0.4490011 2.4355613 2.3907183 ] [ 2.3177535 2.0333786 0.2469977 ] [ 2.8988824 0.2527671 1.5751697 ] [ 2.7582575 2.3598351 2.4767288 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.912681e-11 9.840463e-11 6.185615000000001e-11 ] [ 8.771911e-11 2.004093e-11 2.6958027e-10 ] [ 4.490011e-11 2.4355613e-10 2.3907183e-10 ] [ 2.3177535e-10 2.0333786e-10 2.469977e-11 ] [ 2.8988824e-10 2.527671e-11 1.5751697e-10 ] [ 2.7582575e-10 2.3598351e-10 2.4767288e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-05 1.66e-05 -5.89e-05 ] [ -5e-07 -2.25e-05 -6.7e-06 ] [ 9e-07 2.06e-05 6.54e-05 ] [ -1.2e-05 -4.28e-05 -4.6e-05 ] [ 2.59e-05 -2.19e-05 1.79e-05 ] [ -3e-07 5.01e-05 2.82e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.243047287599999e-14 2.65961321244e-14 -9.436820374259999e-14 ] [ -8.010883169999999e-16 -3.6048974265e-14 -1.07345834478e-14 ] [ 1.4419589706e-15 3.300483866039999e-14 1.047823518636e-13 ] [ -1.9226119608e-14 -6.857315993519999e-14 -7.370012516399999e-14 ] [ 4.149637482059999e-14 -3.50876682846e-14 2.86789617486e-14 ] [ -4.806529901999999e-16 8.026904936339999e-14 4.51813810788e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.861634 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.143490571185995e-18 } }