{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1566283 0.5933374 0.8739195 ] [ 1.297564 0.9258578 2.544594 ] [ 0.4571517 2.983075 2.098516 ] [ 2.386894 1.49419 0.7409216 ] [ 2.718839 0.4423949 1.931638 ] [ 1.685227 2.953094 0.1464224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.566283e-11 5.933374e-11 8.739195e-11 ] [ 1.297564e-10 9.258578e-11 2.544594e-10 ] [ 4.571517e-11 2.983075e-10 2.098516e-10 ] [ 2.386894e-10 1.49419e-10 7.409215999999999e-11 ] [ 2.718839e-10 4.423949e-11 1.931638e-10 ] [ 1.685227e-10 2.953094e-10 1.464224e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.4626847 -1.8273999 -5.5977492 ] [ -36.7209435 10.0202614 27.7039267 ] [ -0.565602 1.7698444 -0.091758 ] [ 7.5883683 4.8379243 -27.7304977 ] [ 46.6904967 -39.7739193 15.722077 ] [ -11.5296348 24.973289 -10.0059988 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.752185713141861e-09 -2.927817396632258e-09 -8.968582897341903e-09 ] [ -5.883343716941772e-08 1.605422854938468e-08 4.438658366309689e-08 ] [ -9.061943010777217e-10 2.835603320133803e-09 -1.470125223713664e-10 ] [ 1.215790628027984e-08 7.751209206660205e-09 -4.442915509808817e-08 ] [ 7.480642222627954e-08 -6.37248436200459e-08 2.51895441998174e-08 ] [ -1.847251132292209e-08 4.001161978028182e-08 -1.603137734511285e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.233009 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.799726440103599e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1336441 0.6950557 0.8428322 ] [ 1.0271606 0.8620325 3.0473035 ] [ 0.2915014 2.8648229 1.9167345 ] [ 2.3193901 1.1566044 0.1103138 ] [ 3.1206892 0.3713778 2.1759063 ] [ 1.8099186 3.4420558 0.2429211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.336441e-11 6.950557e-11 8.428322e-11 ] [ 1.0271606e-10 8.620325e-11 3.0473035e-10 ] [ 2.915014e-11 2.8648229e-10 1.9167345e-10 ] [ 2.3193901e-10 1.1566044e-10 1.103138e-11 ] [ 3.1206892e-10 3.713778e-11 2.1759063e-10 ] [ 1.8099186e-10 3.4420558e-10 2.429211e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0498809 0.2333489 0.0834527 ] [ -0.1257786 0.1970599 -0.0082406 ] [ -0.0954004 -0.3495062 -0.0323552 ] [ -0.0495105 -0.025199 0.0475874 ] [ 0.1319048 -0.0166138 -0.1227432 ] [ 0.0889039 -0.0390898 0.0322989 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.991801180446272e-11 3.738661520693971e-10 1.337059648826362e-10 ] [ -2.015195323169549e-10 3.157247646771859e-10 -1.320289666136448e-11 ] [ -1.528482904949683e-10 -5.59970662464649e-10 -5.183874500130816e-11 ] [ -7.93245655841184e-11 -4.03732486675392e-11 7.624341972465792e-11 ] [ 2.113347867312998e-10 -2.661824194264704e-11 -1.966562854021786e-10 ] [ 1.424397500779411e-10 -6.262876367174784e-11 5.174854245755712e-11 ] ] } "relaxed-potential-energy" { "source-value" -18.137696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.905979248637768e-18 } }