{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7008003 0.3065053 0.9901513 ] [ 0.2115747 0.1616907 -0.6034829 ] [ -2.2608269 0.4866774 0.8752845 ] [ -4.0431216 1.1500265 -1.4784608 ] [ 1.6453958 -1.4660432 1.2367641 ] [ 1.4793994 -3.0366769 -4.1289043 ] [ 2.2667783 2.3978202 3.1086481 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.122805856509626e-09 4.910756258112902e-10 1.586397263914727e-09 ] [ 3.389800378927738e-10 2.590570593407865e-10 -9.668861934325844e-10 ] [ -3.62224400285574e-09 7.797431521517298e-10 1.402360362448618e-09 ] [ -6.47779490257149e-09 1.842545571600451e-09 -2.368755328529265e-09 ] [ 2.636214682722512e-09 -2.348860140122819e-09 1.981514526464754e-09 ] [ 2.370259131505547e-09 -4.865292734103419e-09 -6.61523393898059e-09 ] [ 3.631779196796769e-09 3.84173146532198e-09 4.98060330811434e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.625785 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.304615051264733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0262251 3.0743722 1.2098949 ] [ 1.6889821 1.4579662 2.8437237 ] [ 1.1637542 3.1299518 4.4002625 ] [ 1.4980102 4.7572305 2.7766217 ] [ 3.4706198 2.3890959 4.2097189 ] [ 4.2138397 3.044773 1.9905166 ] [ 3.6891569 4.7171233 3.5468549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0262251e-10 3.0743722e-10 1.2098949e-10 ] [ 1.6889821e-10 1.4579662e-10 2.8437237e-10 ] [ 1.1637542e-10 3.1299518e-10 4.4002625e-10 ] [ 1.4980102e-10 4.7572305e-10 2.776621700000001e-10 ] [ 3.4706198e-10 2.3890959e-10 4.2097189e-10 ] [ 4.213839700000001e-10 3.044773e-10 1.9905166e-10 ] [ 3.6891569e-10 4.717123300000001e-10 3.5468549e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-06 2.8e-06 1.18e-05 ] [ 4.6e-06 -3.94e-05 -5.4e-06 ] [ -1.08e-05 2.57e-05 3.61e-05 ] [ 3.7e-05 6e-07 -2.07e-05 ] [ -4e-06 1.08e-05 -3.96e-05 ] [ -1.7e-06 1.56e-05 4e-06 ] [ -2.63e-05 -1.6e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-15 4.48609453824e-15 1.890568412544e-14 ] [ 7.370012455680001e-15 -6.312575885952001e-14 -8.65175375232e-15 ] [ -1.730350750464e-14 4.117593915456e-14 5.783857601088001e-14 ] [ 5.92805349696e-14 9.6130597248e-16 -3.316505605055999e-14 ] [ -6.4087064832e-15 1.730350750464e-14 -6.344619418368e-14 ] [ -2.72370025536e-15 2.499395528448e-14 6.4087064832e-15 ] [ -4.213724512704e-14 -2.56348259328e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.96247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.678993258982137e-18 } }