{ "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" [ [ 0.2869528 0.4871961 1.041667 ] [ 1.49337 1.111154 0.3370846 ] [ 0.208303 2.963803 0.6319363 ] [ 0.9157171 2.598087 2.560793 ] [ 2.236963 2.266905 1.430037 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.869528e-11 4.871961e-11 1.041667e-10 ] [ 1.49337e-10 1.111154e-10 3.370846e-11 ] [ 2.08303e-11 2.963803e-10 6.319363e-11 ] [ 9.157170999999999e-11 2.598087e-10 2.560793e-10 ] [ 2.236963e-10 2.266905e-10 1.430037e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -41.9034613 -22.162417 25.072723 ] [ 33.2344444 3.5757586 -40.5353276 ] [ -6.3826634 4.8786781 -7.2933152 ] [ -15.3029521 3.0363447 21.42288 ] [ 30.3546324 10.6716356 1.3330398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.713674657858325e-08 -3.550810667036438e-08 4.017093094135437e-08 ] [ 5.324745026165214e-08 5.728996877744552e-09 -6.49447547322553e-08 ] [ -1.0226154162167e-08 7.816504056627515e-09 -1.168517919783704e-08 ] [ -2.451803228584123e-08 4.864760531109739e-09 3.432323776898592e-08 ] [ 4.863348276493933e-08 1.709784520488257e-08 2.135765219752033e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 13.439455 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.153238077469447e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2151459 0.5905289 1.3492711 ] [ 1.7453725 0.9499668 -0.1619291 ] [ 0.3275921 2.8404157 0.5184456 ] [ 0.661482 2.3434018 2.9034623 ] [ 2.6220052 2.702832 1.392268 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.151459e-11 5.905289000000001e-11 1.3492711e-10 ] [ 1.7453725e-10 9.499668e-11 -1.619291e-11 ] [ 3.275921e-11 2.8404157e-10 5.184455999999999e-11 ] [ 6.614820000000001e-11 2.3434018e-10 2.9034623e-10 ] [ 2.6220052e-10 2.702832e-10 1.392268e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.86e-05 -2.01e-05 -7.6e-06 ] [ 1.44e-05 -2.36e-05 -1.8e-05 ] [ -4.6e-06 6.7e-06 -2.2e-06 ] [ -2.6e-06 2.8e-06 3.22e-05 ] [ 3.14e-05 3.41e-05 -4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.18440180724e-14 -3.22037503434e-14 -1.21765424184e-14 ] [ 2.30713435296e-14 -3.78113685624e-14 -2.8839179412e-14 ] [ -7.370012516399999e-15 1.07345834478e-14 -3.5247885948e-15 ] [ -4.165659248399999e-15 4.486094575199999e-15 5.159008761479998e-14 ] [ 5.030834630759999e-14 5.46342232194e-14 -7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.312367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.293093998463268e-18 } }