{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.533343 -1.207647 -1.7008917 ] [ -4.7532798 -1.5172155 2.537238 ] [ -6.8062804 4.0829364 -2.6517594 ] [ 4.5701188 -5.9176704 -4.0069247 ] [ 1.6806496 -2.9566017 2.5053756 ] [ 3.2230923 2.4170645 -3.2463401 ] [ 2.6190425 5.0991337 6.5633023 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.545096854673344e-10 -1.934863789579258e-09 -2.725128916252767e-09 ] [ -7.615593767680898e-09 -2.430847202815382e-09 4.06510340500535e-09 ] [ -1.090486333148927e-08 6.541585244293318e-09 -4.248586914666636e-09 ] [ 7.322137495638552e-09 -9.481153164480186e-09 -6.419801075646054e-09 ] [ 2.692697496876872e-09 -4.736998120757536e-09 4.014054212642772e-09 ] [ 5.163963129740499e-09 3.872564232865642e-09 -5.201210211385534e-09 ] [ 4.196168662381584e-09 8.169712800473401e-09 1.051556950030287e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1409017 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.144098575517098e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2537616 1.4028053 1.606747 ] [ 1.0472071 1.1169221 3.9613641 ] [ 1.4051341 3.7486236 1.228813 ] [ 3.673509 1.3166148 1.8406937 ] [ 3.393153 1.3971522 4.2557018 ] [ 3.7129855 3.7487064 1.8140052 ] [ 3.7994018 3.7422966 4.1933124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2537616e-10 1.4028053e-10 1.606747e-10 ] [ 1.0472071e-10 1.1169221e-10 3.9613641e-10 ] [ 1.4051341e-10 3.748623600000001e-10 1.228813e-10 ] [ 3.673509e-10 1.3166148e-10 1.8406937e-10 ] [ 3.393153e-10 1.3971522e-10 4.2557018e-10 ] [ 3.7129855e-10 3.7487064e-10 1.8140052e-10 ] [ 3.7994018e-10 3.7422966e-10 4.1933124e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 -6.6e-06 4.3e-06 ] [ 3.6e-06 1.06e-05 8e-06 ] [ 1.08e-05 1e-05 -4.6e-06 ] [ 5.7e-06 1.2e-06 1.3e-06 ] [ 4.7e-06 4.5e-06 -1e-05 ] [ -1.38e-05 -2.9e-06 -6.2e-06 ] [ -1.26e-05 -1.68e-05 7.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.56348259328e-15 -1.057436569728e-14 6.889359469440001e-15 ] [ 5.76783583488e-15 1.698307218048e-14 1.28174129664e-14 ] [ 1.730350750464e-14 1.6021766208e-14 -7.370012455680001e-15 ] [ 9.13240673856e-15 1.92261194496e-15 2.08282960704e-15 ] [ 7.53023011776e-15 7.2097947936e-15 -1.6021766208e-14 ] [ -2.211003736704e-14 -4.646312200320001e-15 -9.93349504896e-15 ] [ -2.018742542208e-14 -2.691656722944e-14 1.169588933184e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }