{ "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" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.537609 3.8407779 2.1954069 ] [ 1.6639755 -1.6779479 -3.0209599 ] [ 0.1646387 -3.9054864 -2.553357 ] [ 0.6671686 -0.9144036 1.3391357 ] [ -0.5513739 -2.8954696 3.277915 ] [ 0.073505 0.8813659 -1.9370567 ] [ 1.5196952 4.6711637 0.698916 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.667874433331667e-09 6.153604557065321e-09 3.517429608323004e-09 ] [ 2.665982643683991e-09 -2.688368896300457e-09 -4.840111324154306e-09 ] [ 2.63780276018905e-10 -6.257279002932358e-09 -4.090928889956025e-09 ] [ 1.068921933051867e-09 -1.465036069895355e-09 2.145531910618643e-09 ] [ -8.833983718993171e-10 -4.639053699357128e-09 5.251798777969633e-09 ] [ 1.17767992511904e-10 1.412103839350351e-09 -3.103506957903999e-09 ] [ 2.43482012018198e-09 7.484029272069625e-09 1.119786875103053e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.012459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924608096811855e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8377476 4.0570199 3.4080676 ] [ 5.4339818 2.7137291 1.7022925 ] [ 3.4697678 1.2069058 1.9318758 ] [ 5.4415091 2.2160349 4.1381795 ] [ 3.1824663 1.8900359 4.0911646 ] [ 3.1114749 3.4595981 1.2217596 ] [ 5.0831586 4.4687144 3.4280698 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8377476e-10 4.0570199e-10 3.4080676e-10 ] [ 5.4339818e-10 2.7137291e-10 1.7022925e-10 ] [ 3.4697678e-10 1.2069058e-10 1.9318758e-10 ] [ 5.4415091e-10 2.2160349e-10 4.1381795e-10 ] [ 3.1824663e-10 1.8900359e-10 4.0911646e-10 ] [ 3.1114749e-10 3.4595981e-10 1.2217596e-10 ] [ 5.0831586e-10 4.4687144e-10 3.4280698e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 -1.12e-05 -1.06e-05 ] [ -3.1e-06 -1.64e-05 1.95e-05 ] [ 4.64e-05 4.3e-05 -1.57e-05 ] [ -3.51e-05 4e-06 -4.19e-05 ] [ -7e-07 3.04e-05 9.3e-06 ] [ -1.86e-05 -3.08e-05 3.63e-05 ] [ 1.21e-05 -1.91e-05 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 -1.794437815296e-14 -1.698307218048e-14 ] [ -4.96674752448e-15 -2.627569658112e-14 3.12424441056e-14 ] [ 7.434099520512001e-14 6.889359469439999e-14 -2.515417294656e-14 ] [ -5.623639939008e-14 6.4087064832e-15 -6.713120041152e-14 ] [ -1.12152363456e-15 4.870616927232e-14 1.490024257344e-14 ] [ -2.980048514688e-14 -4.934703992064001e-14 5.815901133504e-14 ] [ 1.938633711168e-14 -3.060157345728e-14 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }