{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3017147 0.0287704 0.1888974 ] [ -0.9363784 0.6177112 -1.6724332 ] [ -5.9076392 3.3530495 3.3203613 ] [ -1.3135038 -5.1376342 -5.5377209 ] [ 3.4129505 -3.8816176 5.4020267 ] [ 2.6186568 2.8211273 -1.8310458 ] [ 2.4276288 2.1985935 0.1299145 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.834002384916857e-10 4.609526225106432e-11 3.026469980099059e-10 ] [ -1.500243580702111e-09 9.89682443046313e-10 -2.679533372889731e-09 ] [ -9.465081410361617e-09 5.37217751728513e-09 5.319805247469095e-09 ] [ -2.104465079691959e-09 -8.231397401462512e-09 -8.872406958495535e-09 ] [ 5.468149499047671e-09 -6.219036969605805e-09 8.655000883677376e-09 ] [ 4.195550702858942e-09 4.519944204360628e-09 -2.933658772374033e-09 ] [ 3.889490107340759e-09 3.522535104342845e-09 2.081459746029216e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.627461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.183359941506379e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3018483 1.7294216 2.2963777 ] [ 1.8205834 4.0533266 1.5092587 ] [ 2.160219 3.4596013 3.9654392 ] [ 3.6662809 1.1859979 1.8954369 ] [ 4.1104418 1.8381836 4.2268089 ] [ 4.1941805 3.4743906 1.2113214 ] [ 4.5626842 4.2045203 3.5303091 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3018483e-10 1.7294216e-10 2.2963777e-10 ] [ 1.8205834e-10 4.0533266e-10 1.5092587e-10 ] [ 2.160219e-10 3.4596013e-10 3.9654392e-10 ] [ 3.6662809e-10 1.1859979e-10 1.8954369e-10 ] [ 4.1104418e-10 1.8381836e-10 4.2268089e-10 ] [ 4.1941805e-10 3.4743906e-10 1.2113214e-10 ] [ 4.5626842e-10 4.204520300000001e-10 3.5303091e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 -1.04e-05 -9.3e-06 ] [ 1.5e-06 -2.17e-05 1.6e-05 ] [ -5.9e-06 -1.55e-05 -3.04e-05 ] [ -7.31e-05 1.08e-05 5.53e-05 ] [ 3.33e-05 3.64e-05 -9.23e-05 ] [ 4.57e-05 6e-06 6.99e-05 ] [ -5.7e-06 -5.5e-06 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.72914180736e-15 -1.666263685632e-14 -1.490024257344e-14 ] [ 2.4032649312e-15 -3.476723267136e-14 2.56348259328e-14 ] [ -9.45284206272e-15 -2.48337376224e-14 -4.870616927232e-14 ] [ -1.1711911098048e-13 1.730350750464e-14 8.860036713024e-14 ] [ 5.335248147264001e-14 5.831922899712e-14 -1.4788090209984e-13 ] [ 7.321947157056e-14 9.6130597248e-15 1.1199214579392e-13 ] [ -9.13240673856e-15 -8.8119714144e-15 -1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.30807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.933276172596986e-18 } }