{ "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" [ [ 1.02058 1.85993 1.630827 ] [ 2.141944 2.227969 3.994537 ] [ 1.553014 3.937737 2.507181 ] [ 3.345417 1.636187 2.240659 ] [ 3.907909 3.941805 1.929299 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.02058e-10 1.85993e-10 1.630827e-10 ] [ 2.141944e-10 2.227969e-10 3.994537e-10 ] [ 1.553014e-10 3.937737e-10 2.507181e-10 ] [ 3.345417e-10 1.636187e-10 2.240659e-10 ] [ 3.907909e-10 3.941805e-10 1.929299e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.7597157 -3.0014102 -5.2553072 ] [ -0.7220332 -1.3989717 9.6156311 ] [ -4.020843 9.1143401 -0.0701392 ] [ 7.7617759 -6.389365 -2.9591566 ] [ 1.7408161 1.6754067 -1.3310282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.625905216194707e-09 -4.808789251870652e-09 -8.41993033096191e-09 ] [ -1.156824712481411e-09 -2.241399750900832e-09 1.540593934265739e-08 ] [ -6.442100650507334e-09 1.460278262223993e-08 -1.123753864416154e-10 ] [ 1.243573588286888e-08 -1.023689122475779e-08 -4.741091521806017e-09 ] [ 2.789094856532235e-09 2.684297445071679e-09 -2.132542263665506e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.1596473 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.307319613803384e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1603985 1.9633938 1.262872 ] [ 2.2686752 2.3490856 4.2977032 ] [ 1.4054042 4.02088 2.6562052 ] [ 3.3821413 1.4205712 2.264796 ] [ 3.7522448 3.8496973 1.8209266 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1603985e-10 1.9633938e-10 1.262872e-10 ] [ 2.2686752e-10 2.3490856e-10 4.2977032e-10 ] [ 1.4054042e-10 4.02088e-10 2.6562052e-10 ] [ 3.3821413e-10 1.4205712e-10 2.264796e-10 ] [ 3.7522448e-10 3.8496973e-10 1.8209266e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.5e-06 2.2e-06 -2e-07 ] [ 4e-06 -4.1e-06 -3.5e-06 ] [ -7e-07 1.8e-06 -4.1e-06 ] [ 2e-06 -2.8e-06 6.6e-06 ] [ -9e-07 2.9e-06 1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.2097947936e-15 3.52478856576e-15 -3.2043532416e-16 ] [ 6.4087064832e-15 -6.568924145279999e-15 -5.6076181728e-15 ] [ -1.12152363456e-15 2.88391791744e-15 -6.568924145279999e-15 ] [ 3.2043532416e-15 -4.48609453824e-15 1.057436569728e-14 ] [ -1.44195895872e-15 4.646312200320001e-15 1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.458486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.835851837896411e-18 } }