{ "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" [ [ 0.4711414 1.535718 0.6051258 ] [ 0.1383881 2.176586 2.72717 ] [ 2.449817 0.7251628 0.0780297 ] [ 1.858809 0.1214998 2.575793 ] [ 2.444403 2.05802 2.37174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711414e-11 1.535718e-10 6.051258000000001e-11 ] [ 1.383881e-11 2.176586e-10 2.72717e-10 ] [ 2.449817e-10 7.251628e-11 7.80297e-12 ] [ 1.858809e-10 1.214998e-11 2.575793e-10 ] [ 2.444403e-10 2.05802e-10 2.37174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.03832 5.3678369 -14.4977162 ] [ -8.5790524 7.7803973 20.3042106 ] [ 27.7406533 -11.0421066 -6.8792616 ] [ -26.1747328 -94.6256184 10.2490059 ] [ 34.0514519 92.5194909 -9.1762388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.332016416970905e-08 8.600222785447548e-09 -2.322790195063341e-08 ] [ -1.374515718389813e-08 1.246557065459544e-08 3.253093152711954e-08 ] [ 4.444542616297837e-08 -1.769140503890138e-08 -1.10217921038872e-08 ] [ -4.193654494784693e-08 -1.516069535292223e-07 1.642071763942126e-08 ] [ 5.455644013847574e-08 1.482325652882983e-07 -1.470195527223785e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.5517554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.894892706280153e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0147101 1.6814136 0.1206202 ] [ 0.2771946 1.9432446 2.6446411 ] [ 2.360433 0.7775659 0.3779252 ] [ 1.869142 -0.1545174 2.7961271 ] [ 2.870499 2.36928 2.418545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47101e-12 1.6814136e-10 1.206202e-11 ] [ 2.771946e-11 1.9432446e-10 2.6446411e-10 ] [ 2.360433e-10 7.775659000000001e-11 3.779252e-11 ] [ 1.869142e-10 -1.545174e-11 2.7961271e-10 ] [ 2.870499e-10 2.36928e-10 2.418545e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 1.7e-06 -1.16e-05 ] [ -7e-07 4e-06 9.9e-06 ] [ -5.3e-06 2.2e-06 -1.43e-05 ] [ 6.4e-06 -5.4e-06 1.43e-05 ] [ -5.7e-06 -2.5e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 2.72370025536e-15 -1.858524880128e-14 ] [ -1.12152363456e-15 6.4087064832e-15 1.586154854592e-14 ] [ -8.491536090240001e-15 3.52478856576e-15 -2.291112567744e-14 ] [ 1.025393037312e-14 -8.65175375232e-15 2.291112567744e-14 ] [ -9.13240673856e-15 -4.005441552e-15 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.556674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.652671600100722e-18 } }