{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3710114 -4.1312068 1.0261827 ] [ -2.1495096 4.4253436 -0.007789 ] [ 0.0748387 -0.0711517 1.6634809 ] [ 1.6089614 -1.1832404 -4.5066999 ] [ 3.8367209 0.9602554 1.8248252 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.400955653530277e-09 -6.618922950649982e-09 1.64412593060942e-09 ] [ -3.44389402730516e-09 7.090182054926906e-09 -1.24793536994112e-11 ] [ 1.199048154710649e-10 -1.139975902701754e-10 2.665190207127343e-09 ] [ 2.577840338849637e-09 -1.89576010566604e-09 -7.220529216741698e-09 ] [ 6.147104526514735e-09 1.538498751876952e-09 2.923692272486684e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3981346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.345529491445156e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0644733 0.2920365 2.116419 ] [ 2.0824225 3.5811645 1.5852276 ] [ 2.7370291 2.1934303 3.4635235 ] [ 3.2983955 1.728004 0.6005913 ] [ 4.9062496 2.0089418 2.3945208 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0644733e-10 2.920365e-11 2.116419e-10 ] [ 2.0824225e-10 3.5811645e-10 1.5852276e-10 ] [ 2.7370291e-10 2.1934303e-10 3.4635235e-10 ] [ 3.2983955e-10 1.728004e-10 6.005913000000001e-11 ] [ 4.9062496e-10 2.0089418e-10 2.3945208e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -5.2e-06 6.8e-06 ] [ -4.1e-06 5.8e-06 -7e-07 ] [ 2.7e-06 -5e-06 -1.6e-06 ] [ 2.9e-06 8e-07 -1.08e-05 ] [ 7e-06 3.5e-06 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -8.33131842816e-15 1.089480102144e-14 ] [ -6.568924145279999e-15 9.292624400640001e-15 -1.12152363456e-15 ] [ 4.32587687616e-15 -8.010883104e-15 -2.56348259328e-15 ] [ 4.646312200320001e-15 1.28174129664e-15 -1.730350750464e-14 ] [ 1.12152363456e-14 5.6076181728e-15 1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.415273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.668710689984948e-18 } }