{ "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" [ [ 0.6305471 0.004372 1.304235 ] [ 0.7154426 1.383697 2.938133 ] [ 2.486494 1.164331 0.5043625 ] [ 2.840403 0.4835428 2.252778 ] [ 2.544628 2.936148 1.00011 ] [ 2.473494 2.502288 2.980444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.305471000000001e-11 4.372e-13 1.304235e-10 ] [ 7.154426000000001e-11 1.383697e-10 2.938133e-10 ] [ 2.486494e-10 1.164331e-10 5.043625000000001e-11 ] [ 2.840403e-10 4.835428e-11 2.252778e-10 ] [ 2.544628e-10 2.936148e-10 1.00011e-10 ] [ 2.473494e-10 2.502288e-10 2.980444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.6162236 -11.3254529 -8.0224116 ] [ -36.959037 0.6005193 30.6271492 ] [ 13.0174652 -17.6401645 -53.0630127 ] [ 30.2531619 -36.2819896 19.9970579 ] [ 5.4240746 41.2460157 -20.859116 ] [ 5.8805589 23.4010719 31.3203332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.822430159870521e-08 -1.814537585635156e-08 -1.285332030795472e-08 ] [ -5.921490500868217e-08 9.621379827991813e-10 4.907010240999343e-08 ] [ 2.08562784055176e-08 -2.826265914896613e-08 -8.501631837715349e-08 ] [ 4.847090870145731e-08 -5.813015549322875e-08 3.203881865216395e-08 ] [ 8.690325513595112e-09 6.608340205568976e-08 -3.341998798575522e-08 ] [ 9.421693986817365e-09 3.749265029983984e-08 5.018070560870605e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 28.339797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.540536019161798e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2984504 0.2735005 1.0676749 ] [ 0.2609246 1.4432346 3.1536565 ] [ 2.4953737 0.756514 0.2648033 ] [ 3.692602 0.4007972 2.4286289 ] [ 2.5014388 3.1865846 0.8450862 ] [ 2.4422193 2.4137479 3.2202126 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.984504e-11 2.735005e-11 1.0676749e-10 ] [ 2.609246e-11 1.4432346e-10 3.1536565e-10 ] [ 2.4953737e-10 7.56514e-11 2.648033e-11 ] [ 3.692602e-10 4.007972000000001e-11 2.4286289e-10 ] [ 2.5014388e-10 3.1865846e-10 8.450862e-11 ] [ 2.4422193e-10 2.4137479e-10 3.2202126e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.7e-06 1.06e-05 -2.83e-05 ] [ -3.3e-06 -8.7e-06 2.67e-05 ] [ 1.98e-05 3.7e-06 5.04e-05 ] [ -3.2e-05 3.98e-05 -1.62e-05 ] [ -2.5e-06 -2.28e-05 7.6e-06 ] [ 2.37e-05 -2.26e-05 -4.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.13240673856e-15 1.698307218048e-14 -4.534159836864e-14 ] [ -5.28718284864e-15 -1.393893660096e-14 4.277811577536e-14 ] [ 3.172309709184e-14 5.928053496960001e-15 8.074970168832e-14 ] [ -5.12696518656e-14 6.376662950784e-14 -2.595526125696e-14 ] [ -4.005441552e-15 -3.652962695424e-14 1.217654231808e-14 ] [ 3.797158591296e-14 -3.620919163008e-14 -6.456771781824e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.021911 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.246557798313835e-18 } }