{ "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" [ [ 0.049795 0.7119441 0.3423404 ] [ 0.1447331 1.623908 1.772641 ] [ 2.54973 0.1092944 1.824085 ] [ 1.77811 2.382187 0.8238028 ] [ 2.019176 2.140924 2.983896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.9795e-12 7.119441e-11 3.423404e-11 ] [ 1.447331e-11 1.623908e-10 1.772641e-10 ] [ 2.54973e-10 1.092944e-11 1.824085e-10 ] [ 1.77811e-10 2.382187e-10 8.238028e-11 ] [ 2.019176e-10 2.140924e-10 2.983896e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.06775 -10.7826879 -14.1652709 ] [ -11.1599402 7.7068691 15.4851737 ] [ 2.6494243 -6.4391013 -0.1715953 ] [ 4.3870478 7.5928542 -9.8211048 ] [ 4.191218 1.9220659 8.6727974 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.085474660592e-10 -1.727577046276305e-08 -2.269526586327857e-08 ] [ -1.788019527796608e-08 1.234776549158594e-08 2.480998327116703e-08 ] [ 4.244845672039406e-09 -1.031657756182289e-08 -2.749259778991622e-10 ] [ 7.028825419492075e-09 1.216509348438309e-08 -1.573514450098666e-08 ] [ 6.715071492276135e-09 3.079489048616911e-09 1.389535323121503e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.3298844 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.130709694046636e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4914478 0.8051985 0.6000069 ] [ -0.4343215 1.4751594 2.1831598 ] [ 2.5119603 -0.292077 1.8924755 ] [ 2.0790431 2.8890457 0.2931967 ] [ 1.8934145 2.0909308 2.7779262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.914478e-11 8.051985e-11 6.000069e-11 ] [ -4.343215000000001e-11 1.4751594e-10 2.1831598e-10 ] [ 2.5119603e-10 -2.92077e-11 1.8924755e-10 ] [ 2.0790431e-10 2.8890457e-10 2.931967e-11 ] [ 1.8934145e-10 2.0909308e-10 2.7779262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.73e-05 -2e-05 -0.0001054 ] [ -3.8e-06 1.28e-05 9.68e-05 ] [ -1.45e-05 6.57e-05 1.8e-06 ] [ 1.98e-05 -4.57e-05 2.47e-05 ] [ -1.88e-05 -1.28e-05 -1.79e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.771765553984e-14 -3.2043532416e-14 -1.6886941583232e-13 ] [ -6.08827115904e-15 2.050786074624e-14 1.5509069689344e-13 ] [ -2.32315610016e-14 1.0526300398656e-13 2.88391791744e-15 ] [ 3.172309709184e-14 -7.321947157056e-14 3.957376253376001e-14 ] [ -3.012092047104e-14 -2.050786074624e-14 -2.867896151232001e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.64318 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.865443078776614e-18 } }