{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -24.357286 14.0036107 -29.9385775 ] [ 1.6453657 -9.8858516 38.7559792 ] [ 15.9480528 -11.5587035 -10.7980079 ] [ -24.6134833 33.686217 -29.6737935 ] [ 31.3773508 -26.2452727 31.6543997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.902467417533915e-08 2.243625767032472e-08 -4.796688893050892e-08 ] [ 2.636166457206227e-09 -1.583888031021827e-08 6.209392379045109e-08 ] [ 2.555159734344398e-08 -1.851908451445913e-08 -1.73003158085937e-08 ] [ -3.943514749971123e-08 5.397126932059551e-08 -4.7542658196147e-08 ] [ 5.027205787440017e-08 -4.20495623264605e-08 5.071593914479853e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.80115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.050970324935392e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4620932 0.9524877 0.6615459 ] [ 0.5823654 0.5489295 2.8904989 ] [ 1.8399934 -0.0077136 0.6800779 ] [ 1.3970602 2.4722669 1.336638 ] [ 3.0083843 1.0565138 2.6098908 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.620932e-11 9.524877000000001e-11 6.615459e-11 ] [ 5.823654e-11 5.489295e-11 2.8904989e-10 ] [ 1.8399934e-10 -7.713600000000001e-13 6.800779000000001e-11 ] [ 1.3970602e-10 2.4722669e-10 1.336638e-10 ] [ 3.0083843e-10 1.0565138e-10 2.6098908e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-05 -1.18e-05 6.71e-05 ] [ -4.72e-05 -8.8e-06 -4.2e-06 ] [ -2.14e-05 2.45e-05 -5.95e-05 ] [ -1.37e-05 7e-06 -6.65e-05 ] [ 3.53e-05 -1.09e-05 6.31e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.530230117759999e-14 -1.890568412544e-14 1.0750605125568e-13 ] [ -7.562273650176e-14 -1.409915426304e-14 -6.72914180736e-15 ] [ -3.428657968511999e-14 3.92533272096e-14 -9.532950893760001e-14 ] [ -2.194981970496e-14 1.12152363456e-14 -1.065447452832e-13 ] [ 5.655683471424e-14 -1.746372516672e-14 1.0109734477248e-13 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }