{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.441642 1.737365 1.840337 ] [ 1.815126 3.688812 0.8905128 ] [ 2.603472 3.479991 3.236515 ] [ 3.869651 3.231599 1.101882 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.441642e-10 1.737365e-10 1.840337e-10 ] [ 1.815126e-10 3.688812e-10 8.905128000000001e-11 ] [ 2.603472e-10 3.479991e-10 3.236515e-10 ] [ 3.869651e-10 3.231599e-10 1.101882e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1790548 -4.9858474 0.6493251 ] [ -3.9425559 2.6291411 -2.3491214 ] [ -0.1361422 1.4159291 3.3384254 ] [ 5.2577528 0.9407773 -1.6386291 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.889054050765543e-09 -7.988208204969652e-09 1.040333503089713e-09 ] [ -6.31667094121884e-09 4.212348437909056e-09 -3.763707417509367e-09 ] [ -2.181238517413548e-10 2.268568519420649e-09 5.348747170232103e-09 ] [ 8.423848683508073e-09 1.507291407857608e-09 -2.625373255812449e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.097510746151738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.76928924304822e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.1803213 1.6101499 2.3171816 ] [ 2.184521 4.4586741 1.2173811 ] [ 1.7904022 3.2324411 3.0878516 ] [ 3.5746465 2.8365019 0.4468326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1803213e-10 1.6101499e-10 2.3171816e-10 ] [ 2.184521e-10 4.4586741e-10 1.2173811e-10 ] [ 1.7904022e-10 3.2324411e-10 3.0878516e-10 ] [ 3.5746465e-10 2.8365019e-10 4.468326e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.4e-06 -3.1e-06 3.5e-06 ] [ 1.5e-06 6.7e-06 4e-07 ] [ -4.4e-06 -1.2e-06 -9e-07 ] [ -2.5e-06 -2.4e-06 -3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.6517538236e-15 -4.9667475654e-15 5.607618218999999e-15 ] [ 2.403264951e-15 1.07345834478e-14 6.408706536e-16 ] [ -7.0495771896e-15 -1.9226119608e-15 -1.4419589706e-15 ] [ -4.005441585e-15 -3.845223921599999e-15 -4.806529901999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.97474264615174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.437912296382764e-18 } }