{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1308747 -5.3248281 -10.987438 ] [ 2.4693886 -6.4089038 12.1399996 ] [ -5.9940816 -2.5953013 0.2988507 ] [ -5.9105477 10.5898204 1.3020257 ] [ 9.5661154 3.7392127 -2.7534379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.096843845942138e-10 -8.531315091598886e-09 -1.760381628608951e-08 ] [ 3.956396682590043e-09 -1.026819583331628e-08 1.945042353564135e-08 ] [ -9.603577402687457e-09 -4.158131066791847e-09 4.788116046497146e-10 ] [ -9.469741341063213e-09 1.696676266335091e-08 2.086075136220755e-09 ] [ 1.532660644575484e-08 5.990879168138444e-09 -4.411493830204649e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.7854896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.258493073001544e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.089951 2.0751534 1.7126639 ] [ 2.5303323 2.0121092 4.9707356 ] [ 0.449599 2.294085 3.59803 ] [ 1.2383718 4.6747279 3.5374762 ] [ 3.4561802 3.5472414 3.2158903 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.089951e-10 2.0751534e-10 1.7126639e-10 ] [ 2.5303323e-10 2.0121092e-10 4.970735600000001e-10 ] [ 4.495990000000001e-11 2.294085e-10 3.59803e-10 ] [ 1.2383718e-10 4.6747279e-10 3.5374762e-10 ] [ 3.4561802e-10 3.5472414e-10 3.2158903e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.06e-05 -4.4e-06 -6.7e-06 ] [ 1.24e-05 -3.2e-06 6.9e-06 ] [ -2.36e-05 -8.7e-06 -5e-07 ] [ 5.1e-06 1.56e-05 2.6e-06 ] [ -4.5e-06 8e-07 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698307218048e-14 -7.04957713152e-15 -1.073458335936e-14 ] [ 1.986699009792e-14 -5.126965186560001e-15 1.105501868352e-14 ] [ -3.781136825088e-14 -1.393893660096e-14 -8.010883104e-16 ] [ 8.17110076608e-15 2.499395528448e-14 4.16565921408e-15 ] [ -7.2097947936e-15 1.28174129664e-15 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.9990301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.121368239449549e-18 } }