{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8944959 -6.5674842 2.8869817 ] [ -1.681387 6.4442451 -0.6444047 ] [ 0.2241791 -1.056608 1.4247303 ] [ 1.8603272 -1.4507155 -7.5683475 ] [ 5.4913766 2.6305626 3.9010403 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.444023522381455e-09 -1.052226964271339e-08 4.625454584417439e-09 ] [ -2.693878941917049e-09 1.032481883792496e-08 -1.032450144673638e-09 ] [ 3.591745128919853e-10 -1.692872634950247e-09 2.282669577605371e-09 ] [ 2.980572746878326e-09 -2.324302457532183e-09 -1.212582942259013e-08 ] [ 8.798155204528192e-09 4.214625897270863e-09 6.250155565458618e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.094294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937719509188172e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7143231 0.7896928 1.9693272 ] [ 2.3417988 3.1595254 1.6958423 ] [ 2.8557034 1.9404075 3.7777363 ] [ 3.5176825 1.3816181 0.4544836 ] [ 4.6590623 2.5323332 2.2628928 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7143231e-10 7.896928e-11 1.9693272e-10 ] [ 2.3417988e-10 3.1595254e-10 1.6958423e-10 ] [ 2.8557034e-10 1.9404075e-10 3.7777363e-10 ] [ 3.5176825e-10 1.3816181e-10 4.544836e-11 ] [ 4.659062300000001e-10 2.5323332e-10 2.2628928e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 8.3e-06 5.2e-06 ] [ 9.1e-06 -1.57e-05 5.6e-06 ] [ -6.7e-06 3e-07 -1.24e-05 ] [ 3e-07 9.3e-06 1.02e-05 ] [ -7.8e-06 -2.3e-06 -8.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.17110076608e-15 1.329806595264e-14 8.33131842816e-15 ] [ 1.457980724928e-14 -2.515417294656e-14 8.972189076479999e-15 ] [ -1.073458335936e-14 4.8065298624e-16 -1.986699009792e-14 ] [ 4.8065298624e-16 1.490024257344e-14 1.634220153216e-14 ] [ -1.249697764224e-14 -3.68500622784e-15 -1.36185012768e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786262543259e-18 } }