{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9527774 -1.7356065 -1.0781883 ] [ -3.0451652 -0.8138837 1.0308019 ] [ -0.3481137 1.5039652 -0.7753287 ] [ 0.7492088 0.1981699 1.0986108 ] [ 1.6912926 0.847355 -0.2758957 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.52651767510661e-09 -2.780748157208515e-09 -1.727448087080097e-09 ] [ -4.878892489913757e-09 -1.303985436190201e-09 1.651526704856219e-09 ] [ -5.577396315201851e-10 2.409617881936796e-09 -1.242213516575257e-09 ] [ 1.200364823457623e-09 3.175031807262739e-10 1.760168539118385e-09 ] [ 2.709749462652046e-09 1.357612370517984e-09 -4.420336403192506e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4135587 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.508218366766844e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1257007 0.7921602 2.1129517 ] [ 1.1091945 1.8531319 3.1164586 ] [ 1.7128203 3.8873949 2.0213693 ] [ 3.1796225 2.0529136 4.4848076 ] [ 3.9487421 3.1273475 2.3745988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1257007e-10 7.921602e-11 2.1129517e-10 ] [ 1.1091945e-10 1.8531319e-10 3.1164586e-10 ] [ 1.7128203e-10 3.8873949e-10 2.0213693e-10 ] [ 3.1796225e-10 2.0529136e-10 4.4848076e-10 ] [ 3.9487421e-10 3.1273475e-10 2.3745988e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 -1.66e-05 4.4e-06 ] [ -1.7e-06 -8.5e-06 -8.8e-06 ] [ -1.17e-05 1.04e-05 1.51e-05 ] [ -1.09e-05 3.9e-06 9.1e-06 ] [ 2.71e-05 1.08e-05 -1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 -2.659613190528e-14 7.04957713152e-15 ] [ -2.72370025536e-15 -1.36185012768e-14 -1.409915426304e-14 ] [ -1.874546646336e-14 1.666263685632e-14 2.419286697408e-14 ] [ -1.746372516672e-14 6.24848882112e-15 1.457980724928e-14 ] [ 4.341898642368e-14 1.730350750464e-14 -3.172309709184e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }