{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0921808 -7.9391296 -6.9488971 ] [ -7.0713436 -1.9269092 9.285484 ] [ -5.440541 0.8826386 -4.9691954 ] [ 6.7729175 0.1413521 -13.3932586 ] [ 5.974385 -11.8071479 14.3958043 ] [ -3.4437053 17.7182838 -0.100114 ] [ 6.3004681 2.9309122 1.7301769 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.954219785046641e-09 -1.271988783462126e-08 -1.113336047396492e-08 ] [ -1.132954139356371e-08 -3.087248870644432e-09 1.487698537761247e-08 ] [ -8.716707594703853e-09 1.414142929535643e-09 -7.961528694066906e-09 ] [ 1.085141007310718e-08 2.264710299209837e-10 -2.145836580524854e-08 ] [ 9.572019970658209e-09 -1.891713632370782e-08 2.306462108707211e-08 ] [ -5.51742412058505e-09 2.838782006505938e-08 -1.604003102147712e-10 ] [ 1.00944626899162e-08 4.695839004457493e-09 2.77204897902822e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 10.158286 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.627536833659995e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4354685 1.0526412 1.5653406 ] [ 1.8214705 2.4602312 4.1556131 ] [ 1.1558706 3.1026005 1.5435722 ] [ 4.540487 2.4092161 1.2704785 ] [ 4.285132 1.7248557 3.9501571 ] [ 3.1007395 4.4646656 3.0496619 ] [ 5.3663399 3.9849067 3.8732776 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4354685e-10 1.0526412e-10 1.5653406e-10 ] [ 1.8214705e-10 2.4602312e-10 4.1556131e-10 ] [ 1.1558706e-10 3.1026005e-10 1.5435722e-10 ] [ 4.540487e-10 2.4092161e-10 1.2704785e-10 ] [ 4.285132e-10 1.7248557e-10 3.9501571e-10 ] [ 3.1007395e-10 4.4646656e-10 3.0496619e-10 ] [ 5.3663399e-10 3.9849067e-10 3.8732776e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5798059 4.4489367 -1.6190558 ] [ 1.4313942 -0.989436 3.0697019 ] [ 0.2935637 -2.5972244 -2.8206702 ] [ -2.3500947 -1.5676575 -4.688871 ] [ -1.1638908 -0.5532641 5.4081013 ] [ 0.4348574 1.6897398 0.8923108 ] [ -0.2256357 -0.4310946 -0.241517 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.531128078381903e-09 7.127982368159104e-09 -2.594013350530641e-09 ] [ 2.293346322388719e-09 -1.585251226977869e-09 4.918204617005339e-09 ] [ 4.703408968555449e-10 -4.161212212651308e-09 -4.51921184942726e-09 ] [ -3.76526678500599e-09 -2.511664195921776e-09 -7.512399494147116e-09 ] [ -1.864758628924209e-09 -8.864268061479533e-10 8.664733465778087e-09 ] [ 6.967183596618739e-10 2.707261602795268e-09 1.429639502247345e-09 ] [ -3.615082433578425e-10 -6.906896894731277e-10 -3.869528909257536e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.828347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.895110102610982e-18 } }