{ "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" [ [ 0.5633223 0.534565 2.657113 ] [ 0.571871 1.718695 0.3060373 ] [ 0.67165 2.82724 1.843012 ] [ 2.670346 0.5025148 0.7068498 ] [ 2.297338 0.3834159 2.609917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.633223000000001e-11 5.34565e-11 2.657113e-10 ] [ 5.71871e-11 1.718695e-10 3.060373e-11 ] [ 6.7165e-11 2.82724e-10 1.843012e-10 ] [ 2.670346e-10 5.025148000000001e-11 7.068498e-11 ] [ 2.297338e-10 3.834159e-11 2.609917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.202808 -1.5070144 7.4088304 ] [ -2.2907546 -3.2738078 -13.6114735 ] [ -1.5196634 10.7119285 7.7515316 ] [ 6.4350922 -0.5626935 -13.1063795 ] [ 19.5781337 -5.3684127 11.557491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.557281989371121e-08 -2.41450323888894e-09 1.187025485435231e-08 ] [ -3.670193464110056e-09 -5.245218318152682e-09 -2.180798461633875e-08 ] [ -2.434769170965439e-09 1.716240140638121e-08 1.241932270491242e-08 ] [ 1.031015427553244e-08 -9.015343703761247e-10 -2.099873481823239e-08 ] [ 3.13676280930366e-08 -8.601145318745806e-09 1.851714187530641e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.026643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.644863412507975e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6539151 1.1134839 3.4966673 ] [ 1.1288683 2.0856353 -0.151664 ] [ -0.1445023 2.5086198 1.7798762 ] [ 2.7148779 0.4297409 0.3716231 ] [ 2.4213682 -0.1710492 2.6264265 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.539151e-11 1.1134839e-10 3.4966673e-10 ] [ 1.1288683e-10 2.0856353e-10 -1.51664e-11 ] [ -1.445023e-11 2.5086198e-10 1.7798762e-10 ] [ 2.7148779e-10 4.297409e-11 3.716231e-11 ] [ 2.4213682e-10 -1.710492e-11 2.6264265e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 3.03e-05 -4.2e-06 ] [ 2.09e-05 6.9e-06 -1.5e-06 ] [ -1.65e-05 -2.32e-05 1.32e-05 ] [ -7.1e-06 3.6e-06 -1.32e-05 ] [ 3.2e-06 -1.76e-05 5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 4.854595161024e-14 -6.72914180736e-15 ] [ 3.348549137472e-14 1.105501868352e-14 -2.4032649312e-15 ] [ -2.64359142432e-14 -3.717049760256e-14 2.114873139456e-14 ] [ -1.137545400768e-14 5.76783583488e-15 -2.114873139456e-14 ] [ 5.126965186560001e-15 -2.819830852608e-14 9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.57084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853852933101747e-18 } }