{ "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" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1485598 -1.1312744 -2.085408 ] [ -0.4768336 0.6998324 -0.8414116 ] [ -3.8893077 0.5004186 1.8593607 ] [ 0.4870112 -1.0736151 -1.3478873 ] [ 0.3386281 -0.424736 0.9172003 ] [ 3.3919423 1.4293745 1.4981459 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.380190383507239e-10 -1.812501395389547e-09 -3.341191942429287e-09 ] [ -7.63971645931899e-10 1.121255109758354e-09 -1.348089993989921e-09 ] [ -6.231357868037421e-09 8.01758981533467e-10 2.979024243174323e-09 ] [ 7.802779587077529e-10 -1.720121012957854e-09 -2.159553519533236e-09 ] [ 5.425420249659245e-10 -6.805020892121089e-10 1.469516877250746e-09 ] [ 5.43449065216258e-09 2.29011040626769e-09 2.400294335527375e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.037818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.050194691064542e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1788314 3.0163275 1.6271709 ] [ 1.9549475 2.9015103 5.4300312 ] [ 0.8915891 3.6891388 3.4814544 ] [ 4.0377357 1.8128318 2.4297364 ] [ 3.8993567 1.7418556 4.7800243 ] [ 3.3466587 3.851369 3.6308917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1788314e-10 3.0163275e-10 1.6271709e-10 ] [ 1.9549475e-10 2.9015103e-10 5.4300312e-10 ] [ 8.915891000000001e-11 3.6891388e-10 3.4814544e-10 ] [ 4.0377357e-10 1.8128318e-10 2.4297364e-10 ] [ 3.8993567e-10 1.7418556e-10 4.7800243e-10 ] [ 3.3466587e-10 3.851369e-10 3.6308917e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.6e-06 -2e-06 1.06e-05 ] [ -3.1e-06 -5e-07 -1.08e-05 ] [ -4e-06 5.5e-06 5.6e-06 ] [ 1.6e-06 -4.5e-06 1e-07 ] [ 2.8e-06 6.1e-06 -6.8e-06 ] [ -2.9e-06 -4.6e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.972189076479999e-15 -3.2043532416e-15 1.698307218048e-14 ] [ -4.96674752448e-15 -8.010883104e-16 -1.730350750464e-14 ] [ -6.4087064832e-15 8.8119714144e-15 8.972189076479999e-15 ] [ 2.56348259328e-15 -7.2097947936e-15 1.6021766208e-16 ] [ 4.48609453824e-15 9.77327738688e-15 -1.089480102144e-14 ] [ -4.646312200320001e-15 -7.370012455680001e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.017916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.207223701233825e-18 } }