{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.1589274 -29.0300025 25.1540307 ] [ 20.1925535 35.2222842 -38.2363511 ] [ -55.2214746 5.8229943 24.697669 ] [ 91.2165932 11.7365922 84.3485458 ] [ -43.0287447 -23.7518681 -95.9638944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.108292583508453e-08 -4.651119130726555e-08 4.030119990642546e-08 ] [ 3.235203713195321e-08 5.643232027641323e-08 -6.126138779712036e-08 ] [ -8.847455557022104e-08 9.329465330511662e-09 3.957002786005692e-08 ] [ 1.461450930540642e-07 1.880409363070364e-08 1.35141268079238e-07 ] [ -6.893964878071191e-08 -3.805468777014531e-08 -1.537511080486e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 42.202705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.761618728551927e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8816091 0.0531047 2.9938632 ] [ 1.6659721 2.7998857 0.8756747 ] [ -0.1791535 1.6423533 1.6766609 ] [ 2.6507308 1.4736465 2.5057919 ] [ 1.5562526 0.4490134 0.7718063 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.816091e-11 5.31047e-12 2.9938632e-10 ] [ 1.6659721e-10 2.7998857e-10 8.756747e-11 ] [ -1.791535e-11 1.6423533e-10 1.6766609e-10 ] [ 2.6507308e-10 1.4736465e-10 2.5057919e-10 ] [ 1.5562526e-10 4.490134e-11 7.718063e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.01e-05 1e-06 -3.3e-06 ] [ -9.6e-06 -1.7e-06 -8e-06 ] [ 2.64e-05 -2.4e-06 1.19e-05 ] [ -1.54e-05 -5.6e-06 -6.3e-06 ] [ 8.7e-06 8.7e-06 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.618198387008e-14 1.6021766208e-15 -5.28718284864e-15 ] [ -1.538089555968e-14 -2.72370025536e-15 -1.28174129664e-14 ] [ 4.229746278912e-14 -3.84522388992e-15 1.906590178752e-14 ] [ -2.467351996032e-14 -8.972189076479999e-15 -1.009371271104e-14 ] [ 1.393893660096e-14 1.393893660096e-14 9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.467452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.279247308174621e-18 } }