{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1825892 1.618761 -0.1023392 ] [ 1.0588282 -0.5703143 0.0185907 ] [ 1.547318 -2.623094 0.5517612 ] [ -0.2170762 0.9076463 -0.8423256 ] [ -1.2064808 0.6670011 0.374313 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.894716768250575e-09 2.593541028862828e-09 -1.639654736313754e-10 ] [ 1.696429787483747e-09 -9.137442379679175e-10 2.978558490430656e-11 ] [ 2.479076724543014e-09 -4.202659880960755e-09 8.840188949045529e-10 ] [ -3.47794412572105e-10 1.454209681815623e-09 -1.349554383421333e-09 ] [ -1.932995331204081e-09 1.068653568467883e-09 5.997155374615104e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.341527399234948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.955893697616862e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8667357 2.0919119 0.0148243 ] [ 0.3090519 2.3064148 2.291832 ] [ 2.4736912 0.4609538 0.5620515 ] [ 1.9160246 0.6754748 2.8390617 ] [ 2.5535747 2.5862878 1.5982886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.667357e-11 2.0919119e-10 1.48243e-12 ] [ 3.090519e-11 2.3064148e-10 2.291832e-10 ] [ 2.4736912e-10 4.609538e-11 5.620515e-11 ] [ 1.9160246e-10 6.754748000000001e-11 2.8390617e-10 ] [ 2.5535747e-10 2.5862878e-10 1.5982886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.09e-05 -1.16e-05 -3e-06 ] [ 1.8e-06 1.53e-05 6.5e-06 ] [ 1.47e-05 3.5e-06 -5.2e-06 ] [ -9.6e-06 -1.12e-05 -4e-07 ] [ 4e-06 3.9e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.746372516672e-14 -1.858524880128e-14 -4.8065298624e-15 ] [ 2.88391791744e-15 2.451330229824e-14 1.04141480352e-14 ] [ 2.355199632576e-14 5.6076181728e-15 -8.33131842816e-15 ] [ -1.538089555968e-14 -1.794437815296e-14 -6.408706483200001e-16 ] [ 6.4087064832e-15 6.24848882112e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }