{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7870897 1.3616551 -1.4056168 ] [ 3.4961187 0.5344446 0.4492534 ] [ -2.0187097 -2.7622956 2.0617145 ] [ 2.3254746 2.2782734 -1.564637 ] [ -2.00176 -2.5638024 -4.2237861 ] [ -1.9039407 0.4575429 -1.875771 ] [ -1.6842725 0.694182 6.558843 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.863233336612486e-09 2.181611966813086e-09 -2.25204637476371e-09 ] [ 5.601399644681689e-09 8.562746432328077e-10 7.197832942949107e-10 ] [ -3.234329485522182e-09 -4.425685430058709e-09 3.303230770664362e-09 ] [ 3.725821036384232e-09 3.650196377270526e-09 -2.50682482143865e-09 ] [ -3.207173072452608e-09 -4.10766426563093e-09 -6.767251340680011e-09 ] [ -3.050449276929587e-09 7.330645373930323e-10 -3.005316442174637e-09 ] [ -2.698502022556368e-09 1.112202170980186e-09 1.050842491409774e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -25.515077 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.087965984731181e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9582593 1.6879917 2.9839674 ] [ 2.15573 3.6490891 1.549942 ] [ 1.3188021 3.8840398 3.82715 ] [ 2.8859944 5.5212644 2.9294316 ] [ 3.9206581 1.9679829 1.5651351 ] [ 4.4940314 4.3370764 1.5314321 ] [ 3.6753678 3.3102527 3.5849038 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9582593e-10 1.6879917e-10 2.9839674e-10 ] [ 2.15573e-10 3.6490891e-10 1.549942e-10 ] [ 1.3188021e-10 3.8840398e-10 3.82715e-10 ] [ 2.8859944e-10 5.5212644e-10 2.9294316e-10 ] [ 3.9206581e-10 1.9679829e-10 1.5651351e-10 ] [ 4.4940314e-10 4.3370764e-10 1.5314321e-10 ] [ 3.6753678e-10 3.3102527e-10 3.5849038e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 1.09e-05 -9.4e-06 ] [ 1.61e-05 -1.38e-05 3.91e-05 ] [ 8.8e-06 5.6e-06 -1.77e-05 ] [ -4.1e-06 -1.88e-05 1.18e-05 ] [ 1.2e-06 1.85e-05 3.3e-06 ] [ -1.11e-05 -2.24e-05 3.8e-06 ] [ -9.7e-06 2e-05 -3.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 1.746372516672e-14 -1.506046023552e-14 ] [ 2.579504359488e-14 -2.211003736704e-14 6.264510587328001e-14 ] [ 1.409915426304e-14 8.972189076479999e-15 -2.835852618816e-14 ] [ -6.568924145279999e-15 -3.012092047104e-14 1.890568412544e-14 ] [ 1.92261194496e-15 2.96402674848e-14 5.28718284864e-15 ] [ -1.778416049088e-14 -3.588875630592e-14 6.08827115904e-15 ] [ -1.554111322176e-14 3.2043532416e-14 -4.918682225856e-14 ] ] } "relaxed-potential-energy" { "source-value" -31.275942 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.010958306589679e-18 } }