{ "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" [ [ 0.9865114 1.002248 2.003773 ] [ 2.302262 0.4465448 0.4828732 ] [ 2.913212 0.9916658 2.458282 ] [ 2.765138 2.782808 0.4747325 ] [ 1.558206 2.989621 2.793764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.865114e-11 1.002248e-10 2.003773e-10 ] [ 2.302262e-10 4.465448e-11 4.828732e-11 ] [ 2.913212e-10 9.916658000000001e-11 2.458282e-10 ] [ 2.765138e-10 2.782808e-10 4.747325e-11 ] [ 1.558206e-10 2.989621e-10 2.793764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.1577571 -12.1990633 9.0430946 ] [ 2.9017887 -10.64368 -18.7676132 ] [ 22.8621215 -11.6538867 20.2578199 ] [ 10.2982752 19.4474464 -18.1937739 ] [ -4.9044283 15.0491837 7.6604727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.992022998218521e-08 -1.95450540149193e-08 1.448863474780273e-08 ] [ 4.649178013641625e-09 -1.705305525527654e-08 -3.006903109725748e-08 ] [ 3.662915656918903e-08 -1.867158481219206e-08 3.2456605432157e-08 ] [ 1.649965576000445e-08 3.115824395634113e-08 -2.914963918670124e-08 ] [ -7.85776036064989e-09 2.411145028626444e-08 1.227343026421665e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.405674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.308043408966642e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2368172 1.0274906 1.8130661 ] [ 2.4043602 0.4234794 0.523452 ] [ 3.5006528 0.8996361 2.8251047 ] [ 2.5777289 3.000604 0.2898838 ] [ 1.8057704 2.8616775 2.7619181 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.368172e-11 1.0274906e-10 1.8130661e-10 ] [ 2.4043602e-10 4.234794e-11 5.234520000000001e-11 ] [ 3.5006528e-10 8.996361000000001e-11 2.8251047e-10 ] [ 2.5777289e-10 3.000604e-10 2.898838e-11 ] [ 1.8057704e-10 2.8616775e-10 2.7619181e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.35e-05 -3.19e-05 2.22e-05 ] [ 2.2e-05 -5.65e-05 -4.41e-05 ] [ -2.16e-05 2.08e-05 -1.24e-05 ] [ 3.73e-05 2.85e-05 -2.53e-05 ] [ 5.7e-06 3.91e-05 5.95e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.969468300480001e-14 -5.110943420352001e-14 3.556832098176e-14 ] [ 3.52478856576e-14 -9.052297907519999e-14 -7.065598897728e-14 ] [ -3.460701500928e-14 3.332527371264e-14 -1.986699009792e-14 ] [ 5.976118795584e-14 4.56620336928e-14 -4.053506850624e-14 ] [ 9.13240673856e-15 6.264510587328001e-14 9.532950893760001e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.8977283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.425573226049053e-18 } }