{ "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" [ [ 0.1032294 0.9160098 0.6340424 ] [ 0.5975465 2.782152 1.021804 ] [ 1.919093 1.0464 1.488365 ] [ 2.284896 2.976774 2.795304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032294e-11 9.160098e-11 6.340424e-11 ] [ 5.975465e-11 2.782152e-10 1.021804e-10 ] [ 1.919093e-10 1.0464e-10 1.488365e-10 ] [ 2.284896e-10 2.976774e-10 2.795304e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4379192 -4.3443139 -2.1574566 ] [ 0.9762071 5.5537123 1.1559397 ] [ 4.4540338 -0.6855378 1.960963 ] [ -0.9923217 -0.5238606 -0.959446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.110330387239439e-09 -6.96035816399647e-09 -3.456626524910658e-09 ] [ 1.564056192678968e-09 8.898028005709396e-09 1.852019562394566e-09 ] [ 7.136148822612983e-09 -1.098352635834666e-09 3.141809072853831e-09 ] [ -1.589874628052511e-09 -8.393172058782605e-10 -1.537201950120077e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.070215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.094079290182947e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0808611 0.8155096 0.8154517 ] [ 0.789095 2.9608049 0.9083224 ] [ 2.1540975 1.0882281 1.3616399 ] [ 2.0424335 2.8567933 2.8541014 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.086110000000001e-12 8.155096e-11 8.154517000000001e-11 ] [ 7.89095e-11 2.9608049e-10 9.083224e-11 ] [ 2.1540975e-10 1.0882281e-10 1.3616399e-10 ] [ 2.0424335e-10 2.8567933e-10 2.8541014e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.47e-05 2.51e-05 1.14e-05 ] [ -3.8e-06 -1.76e-05 1.5e-06 ] [ -1.13e-05 3.2e-06 -8e-07 ] [ -9.6e-06 -1.07e-05 -1.21e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.957376253376001e-14 4.021463318208e-14 1.826481347712e-14 ] [ -6.08827115904e-15 -2.819830852608e-14 2.4032649312e-15 ] [ -1.810459581504e-14 5.126965186560001e-15 -1.28174129664e-15 ] [ -1.538089555968e-14 -1.714328984256e-14 -1.938633711168e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.547552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.330774770427228e-18 } }