{ "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" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.9295596 -9.2112554 -1.3141449 ] [ 2.8118246 0.3159548 11.5451872 ] [ 1.7486342 1.8555531 -1.5604811 ] [ 3.9685957 -3.5567309 -6.303099 ] [ 0.0931461 -2.8854428 3.6225066 ] [ 5.9482547 10.5689038 -5.4828077 ] [ -8.6408957 2.9130173 -0.5071611 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.500201841030386e-09 -1.475805817168632e-08 -2.105492252470267e-09 ] [ 4.505039673026396e-09 5.062153979601432e-10 1.849742916699588e-08 ] [ 2.801620856653282e-09 2.972923819966265e-09 -2.500166356218617e-09 ] [ 6.358391300332873e-09 -5.69851114140579e-09 -1.009867793958876e-08 ] [ 1.492365049682274e-10 -4.622989032903535e-09 5.803895431030784e-09 ] [ 9.530154693420678e-09 1.69332507153538e-08 -8.784426385655282e-09 ] [ -1.384424118737107e-08 4.667168252497767e-09 -8.125616640937373e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.330151 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.577684616589173e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4121208 0.7600194 1.3861002 ] [ 2.6475633 2.5527504 3.139769 ] [ 2.5916031 0.1202499 3.7934201 ] [ 1.9366636 1.8801957 5.5061571 ] [ 4.674707 0.7002572 2.5212283 ] [ 4.10486 2.6624573 1.0623718 ] [ 4.3648251 1.6774128 4.7604945 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4121208e-10 7.600194e-11 1.3861002e-10 ] [ 2.6475633e-10 2.5527504e-10 3.139769e-10 ] [ 2.5916031e-10 1.202499e-11 3.7934201e-10 ] [ 1.9366636e-10 1.8801957e-10 5.5061571e-10 ] [ 4.674707e-10 7.002572e-11 2.5212283e-10 ] [ 4.104860000000001e-10 2.6624573e-10 1.0623718e-10 ] [ 4.3648251e-10 1.6774128e-10 4.760494500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.98e-05 8.57e-05 4.12e-05 ] [ -5.06e-05 8.45e-05 4.17e-05 ] [ 7e-05 -3.03e-05 -0.0001225 ] [ -0.0001163 6.36e-05 0.0001144 ] [ 8.73e-05 -6.44e-05 -3.1e-06 ] [ -8.23e-05 -9.91e-05 -5.55e-05 ] [ 2.21e-05 -4.01e-05 -1.62e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.118319290532e-13 1.373065375338e-13 6.600967732079998e-14 ] [ -8.107013768039999e-14 1.35383925573e-13 6.681076563779999e-14 ] [ 1.1215236438e-13 -4.854595201019999e-14 -1.962666376649999e-13 ] [ -1.863331425342e-13 1.018984339224e-13 1.832890069296e-13 ] [ 1.398700201482e-13 -1.031801752296e-13 -4.9667475654e-15 ] [ -1.318591369782e-13 -1.587757044294e-13 -8.892080318699998e-14 ] [ 3.54081036114e-14 -6.42472830234e-14 -2.59552614708e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.610099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.263407884622677e-18 } }