{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.7450626 -12.6918815 -7.6633811 ] [ -17.9290878 6.0230735 0.2498032 ] [ -10.157286 9.5237059 3.5009285 ] [ 18.1598353 -5.5583125 3.599415 ] [ 5.1814759 2.7034145 0.3132344 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.602428361952461e-09 -2.033463581326403e-08 -1.227809003470059e-08 ] [ -2.872556530543051e-08 9.65002754706003e-09 4.002288468410266e-10 ] [ -1.627376615997915e-08 1.525865893635502e-08 5.609105793792414e-09 ] [ 2.909526355523856e-08 -8.905398338600402e-09 5.766898561556832e-09 ] [ 8.301639548218639e-09 4.331347508231722e-09 5.018568325103155e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -7.7881854 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.24780485663359e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0790938 0.1045913 1.4233978 ] [ 0.659001 2.3421758 0.5141647 ] [ -0.2994577 1.680392 2.6333455 ] [ 2.8467844 1.3307014 0.3191096 ] [ 2.0828944 2.0698715 2.4911198 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0790938e-10 1.045913e-11 1.4233978e-10 ] [ 6.590009999999999e-11 2.3421758e-10 5.141647000000001e-11 ] [ -2.994577e-11 1.680392e-10 2.6333455e-10 ] [ 2.8467844e-10 1.3307014e-10 3.191096e-11 ] [ 2.0828944e-10 2.0698715e-10 2.4911198e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 -9e-07 9e-07 ] [ -4.4e-06 5.9e-06 6.2e-06 ] [ -5e-07 8e-07 -4.4e-06 ] [ -2.2e-06 -2.8e-06 8e-06 ] [ 9e-07 -2.9e-06 -1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 -1.44195895872e-15 1.44195895872e-15 ] [ -7.04957713152e-15 9.45284206272e-15 9.93349504896e-15 ] [ -8.010883104e-16 1.28174129664e-15 -7.04957713152e-15 ] [ -3.52478856576e-15 -4.48609453824e-15 1.28174129664e-14 ] [ 1.44195895872e-15 -4.646312200320001e-15 -1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }