{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.2347936 11.1596793 20.7231163 ] [ 5.0869468 -19.2699642 -9.9199165 ] [ 10.0501223 -30.2139398 27.217474 ] [ -2.9401549 8.7431415 -43.7697092 ] [ 19.0378793 29.5810832 5.7490353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.004365606143347e-08 1.787977727008571e-08 3.32020924459794e-08 ] [ 8.150187234213373e-09 -3.087388612489298e-08 -1.589345829658816e-08 ] [ 1.610207098524072e-08 -4.840806796981863e-08 4.360720052003186e-08 ] [ -4.710647442310562e-09 1.400805690364624e-08 -7.012680477945468e-08 ] [ 3.050204512407227e-08 4.739411992097965e-08 9.210969949813914e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 21.75413 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.485395849184391e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0097468 3.4671166 3.1445933 ] [ 2.6549679 0.0694053 0.613093 ] [ 2.8004166 0.7546577 2.9481769 ] [ 2.003718 2.334373 -0.0107206 ] [ 2.1483676 3.019455 2.3244896 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.7468e-13 3.4671166e-10 3.1445933e-10 ] [ 2.6549679e-10 6.940530000000001e-12 6.13093e-11 ] [ 2.800416600000001e-10 7.546577e-11 2.9481769e-10 ] [ 2.003718e-10 2.334373e-10 -1.07206e-12 ] [ 2.1483676e-10 3.019455e-10 2.3244896e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -1.96e-05 -2.67e-05 ] [ -3e-05 6.2e-06 5.5e-06 ] [ 1.97e-05 -5.3e-06 -2e-06 ] [ 1.8e-06 -2.8e-06 1e-07 ] [ 9e-06 2.15e-05 2.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -3.140266176767999e-14 -4.277811577536e-14 ] [ -4.8065298624e-14 9.93349504896e-15 8.8119714144e-15 ] [ 3.156287942976e-14 -8.491536090240001e-15 -3.2043532416e-15 ] [ 2.88391791744e-15 -4.48609453824e-15 1.6021766208e-16 ] [ 1.44195895872e-14 3.44467973472e-14 3.717049760256e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.7587726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.563527730742363e-18 } }