{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.391078 -1.9807179 -5.7828718 ] [ -2.6872135 -7.9601039 13.0380531 ] [ -4.0232767 -5.7121107 3.0320498 ] [ 11.3809137 8.7932466 -15.6141402 ] [ -1.2793455 6.8596859 5.326909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.43310593567145e-09 -3.173459937925548e-09 -9.265182075377519e-09 ] [ -4.305390680269358e-09 -1.275349247279227e-08 2.088926402967126e-08 ] [ -6.445999920856627e-09 -9.151810294361383e-09 4.857879342684372e-09 ] [ 1.823423400371048e-08 1.408833423951994e-08 -2.501661058844008e-08 ] [ -2.049737466913047e-09 1.099042846555926e-08 8.534649131244305e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2793703 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.25413046889357e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1367191 1.2183833 0.3811371 ] [ 0.2312548 1.0587755 2.9988992 ] [ 1.8611505 0.0697241 2.7327992 ] [ 2.2383976 2.0482248 1.2079749 ] [ 1.4081778 3.2326126 2.4782321 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.367191e-11 1.2183833e-10 3.811371e-11 ] [ 2.312548e-11 1.0587755e-10 2.9988992e-10 ] [ 1.8611505e-10 6.97241e-12 2.7327992e-10 ] [ 2.2383976e-10 2.0482248e-10 1.2079749e-10 ] [ 1.4081778e-10 3.2326126e-10 2.4782321e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.1e-06 4.36e-05 2.2e-05 ] [ -1.29e-05 2.3e-06 -2.96e-05 ] [ 4.5e-05 5.14e-05 -5e-06 ] [ -3.2e-05 -5.75e-05 3.37e-05 ] [ -9.1e-06 -3.97e-05 -2.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.45798073694e-14 6.985490124239999e-14 3.5247885948e-14 ] [ -2.06680785786e-14 3.685006258199999e-15 -4.74244283664e-14 ] [ 7.209794852999999e-14 8.23518789876e-14 -8.010883169999999e-15 ] [ -5.126965228799999e-14 -9.212515645499998e-14 5.399335256579999e-14 ] [ -1.45798073694e-14 -6.36064123698e-14 -3.38059269774e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.088346 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.776548887090736e-18 } }