{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.3235818 0.6432926 -8.1321791 ] [ -19.8365027 -18.1871449 17.1346961 ] [ -8.8670859 6.305462 4.5673561 ] [ 4.5980791 5.7966008 -17.4696667 ] [ 24.987718 -11.6742328 -5.3287331 ] [ 9.4413733 17.1160223 9.2285268 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.654020140287638e-08 1.030668364053646e-09 -1.302918723017839e-08 ] [ -3.178158086437608e-08 -2.913901835788195e-08 2.745280949593294e-08 ] [ -1.420663772360533e-08 1.010246379974281e-08 7.317711162288266e-09 ] [ 7.366934834609104e-09 9.287178281870578e-09 -2.798949155990829e-08 ] [ 4.003473758674334e-08 -1.870418285793652e-08 -8.537571591303108e-09 ] [ 1.512674756950535e-08 2.742289077015145e-08 1.478572988338624e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.020694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.605492165099084e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1931276 2.0684082 0.2505174 ] [ 1.1215875 -0.2382831 2.8275749 ] [ 0.2795148 2.0291045 2.6061517 ] [ 2.2483624 1.0548516 -0.316079 ] [ 3.1588989 0.60895 1.8123257 ] [ 2.5908625 2.7429664 2.8234881 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931276e-11 2.0684082e-10 2.505174e-11 ] [ 1.1215875e-10 -2.382831e-11 2.8275749e-10 ] [ 2.795148e-11 2.0291045e-10 2.6061517e-10 ] [ 2.2483624e-10 1.0548516e-10 -3.16079e-11 ] [ 3.1588989e-10 6.0895e-11 1.8123257e-10 ] [ 2.5908625e-10 2.7429664e-10 2.8234881e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.2e-06 3.25e-05 2.65e-05 ] [ 2.69e-05 2.36e-05 -8.2e-06 ] [ 5.5e-06 -1.85e-05 -1.88e-05 ] [ 2.4e-06 -4.68e-05 -1.78e-05 ] [ -2.11e-05 1.12e-05 -2.8e-06 ] [ -2e-05 -2e-06 2.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.93349504896e-15 5.207074017599999e-14 4.24576804512e-14 ] [ 4.309855109952001e-14 3.781136825088e-14 -1.313784829056e-14 ] [ 8.8119714144e-15 -2.96402674848e-14 -3.012092047104e-14 ] [ 3.84522388992e-15 -7.498186585344001e-14 -2.851874385024e-14 ] [ -3.380592669888e-14 1.794437815296e-14 -4.48609453824e-15 ] [ -3.2043532416e-14 -3.2043532416e-15 3.396614436096001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.5540646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53072989357329e-18 } }