{ "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" [ [ 0.1724043 0.1217148 2.355607 ] [ 0.0803944 1.628444 0.6781111 ] [ 0.0194903 2.198586 2.964695 ] [ 2.614645 0.684385 2.185781 ] [ 2.191382 2.601245 1.67848 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.724043e-11 1.217148e-11 2.355607e-10 ] [ 8.03944e-12 1.628444e-10 6.781111e-11 ] [ 1.94903e-12 2.198586e-10 2.964695e-10 ] [ 2.614645e-10 6.84385e-11 2.185781e-10 ] [ 2.191382e-10 2.601245e-10 1.67848e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6733538 -2.3882876 0.1953272 ] [ 0.3164656 0.8133887 -0.6211375 ] [ 0.2400514 1.8465319 0.3612802 ] [ 0.4059843 -4.5992957 1.2330081 ] [ -1.6358551 4.3276627 -1.168478 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.078831715886839e-09 -3.826458556466542e-09 3.129486732463258e-10 ] [ 5.070337856074445e-10 1.303192358762905e-09 -9.9517198080216e-10 ] [ 3.846047408703091e-10 2.958470239741404e-09 5.788346899979481e-10 ] [ 6.504585538718535e-10 -7.368884042685971e-09 1.975496751077028e-09 ] [ -2.620928796236446e-09 6.933680000648204e-09 -1.872108133519142e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.271923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.96617881228578e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.239636 0.0530206 2.6427252 ] [ 0.4860862 1.4716391 0.7310165 ] [ -0.1215201 2.4172726 2.8439392 ] [ 2.4176371 0.464095 1.7218981 ] [ 2.0564768 2.8283476 1.9230951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.39636e-11 5.302060000000001e-12 2.6427252e-10 ] [ 4.860862000000001e-11 1.4716391e-10 7.310165e-11 ] [ -1.215201e-11 2.4172726e-10 2.8439392e-10 ] [ 2.4176371e-10 4.64095e-11 1.7218981e-10 ] [ 2.0564768e-10 2.8283476e-10 1.9230951e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.6e-06 1.61e-05 2.4e-06 ] [ 1.11e-05 -1.1e-05 5.4e-06 ] [ 6.3e-06 -7.2e-06 -6.5e-06 ] [ -1.47e-05 1.71e-05 -1.09e-05 ] [ -5.3e-06 -1.5e-05 9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.16565921408e-15 2.579504359488e-14 3.84522388992e-15 ] [ 1.778416049088e-14 -1.76239428288e-14 8.65175375232e-15 ] [ 1.009371271104e-14 -1.153567166976e-14 -1.04141480352e-14 ] [ -2.355199632576e-14 2.739722021568e-14 -1.746372516672e-14 ] [ -8.491536090240001e-15 -2.4032649312e-14 1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }