{ "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" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -29.7340579 40.9825429 2.5191196 ] [ -78.8445415 -215.3391436 -14.1852931 ] [ 27.8321783 -40.6053819 6.3610868 ] [ 80.7464211 214.9619826 5.3050867 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.763921240889355e-08 6.566127209531303e-08 4.036074528119047e-09 ] [ -1.263228810689954e-07 -3.450113414190139e-07 -2.272734496401556e-08 ] [ 4.459206537819708e-08 -6.505699355883548e-08 1.019158455383948e-08 ] [ 1.293700280996918e-07 3.444070628825364e-07 8.499685882057024e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 55.010489 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.813651937457557e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1960214 2.2481803 2.7810834 ] [ 1.6876906 0.4984257 0.6957287 ] [ 2.167173 -0.1227474 3.1647063 ] [ 2.03097 3.0559167 0.4654769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1960214e-10 2.2481803e-10 2.7810834e-10 ] [ 1.6876906e-10 4.984257e-11 6.957287e-11 ] [ 2.167173e-10 -1.227474e-11 3.1647063e-10 ] [ 2.03097e-10 3.0559167e-10 4.654769e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6e-07 6e-06 -2.14e-05 ] [ -1.4e-06 2.65e-05 9e-06 ] [ 6.2e-06 -1.17e-05 1.9e-06 ] [ -4.2e-06 -2.07e-05 1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.6130597248e-16 9.6130597248e-15 -3.428657968511999e-14 ] [ -2.24304726912e-15 4.24576804512e-14 1.44195895872e-14 ] [ 9.93349504896e-15 -1.874546646336e-14 3.04413557952e-15 ] [ -6.72914180736e-15 -3.316505605055999e-14 1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.069862 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.933805071268233e-18 } }