{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -47.2122968 -66.9747059 78.5629013 ] [ 5.375815 80.118802 -81.1974157 ] [ 0.4947307 2.1545001 2.0395306 ] [ 16.2818066 -31.0486607 -14.1786203 ] [ 6.2939534 -2.1759334 10.887863 ] [ 18.7659911 17.9259979 3.8857411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.564243814723066e-08 -1.073053079779358e-07 1.258716437250779e-07 ] [ 8.613005110745952e-09 1.283644714509043e-07 -1.300926011039189e-07 ] [ 7.926459611320186e-10 3.451889689731262e-09 3.267688244726196e-09 ] [ 2.608632987890714e-08 -4.974543828069176e-08 -2.271665395986028e-08 ] [ 1.008402498988467e-08 -3.486229621897854e-09 1.744427954907335e-08 ] [ 3.006643220656088e-08 2.87206147398899e-08 6.225643544901676e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 25.14756 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.029083270216525e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4449902 0.8295567 2.4849667 ] [ -0.108624 1.3257875 0.1076047 ] [ 0.5404356 2.9697225 1.8068559 ] [ 1.9877087 0.3928318 0.2094651 ] [ 1.6513572 -0.1033905 2.586841 ] [ 2.6367739 2.0367671 1.9087052 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.449902e-11 8.295567000000001e-11 2.4849667e-10 ] [ -1.08624e-11 1.3257875e-10 1.076047e-11 ] [ 5.404356e-11 2.9697225e-10 1.8068559e-10 ] [ 1.9877087e-10 3.928318e-11 2.094651e-11 ] [ 1.6513572e-10 -1.033905e-11 2.586841e-10 ] [ 2.6367739e-10 2.0367671e-10 1.9087052e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.35e-05 -2.84e-05 1.34e-05 ] [ -7.47e-05 2.6e-05 8e-07 ] [ -3.22e-05 5.66e-05 -1.58e-05 ] [ 7.59e-05 -4.33e-05 6.9e-06 ] [ -4.34e-05 -2.58e-05 -1.4e-05 ] [ 4.1e-05 1.48e-05 8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.36729167968e-14 -4.550181603071999e-14 2.146916671872e-14 ] [ -1.1968259357376e-13 4.16565921408e-14 1.28174129664e-15 ] [ -5.159008718975999e-14 9.068319673728001e-14 -2.531439060864e-14 ] [ 1.2160520551872e-13 -6.937424768064e-14 1.105501868352e-14 ] [ -6.953446534272e-14 -4.133615681664e-14 -2.24304726912e-14 ] [ 6.56892414528e-14 2.371221398784e-14 1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.293256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930902708150933e-18 } }