{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.1849683e-10 1.4831864e-10 1.7016292e-10 ] [ 1.2209569e-10 2.9384928e-10 2.3344845e-10 ] [ 1.9813573e-10 4.5123314e-10 4.0957271e-10 ] [ 5.1241382e-10 2.1821031e-10 3.084727e-10 ] [ 2.8774143e-10 2.1588373e-10 4.2297238e-10 ] [ 3.620949e-10 4.024197e-10 2.2427174e-10 ] ] "source-value" [ [ 3.1849683 1.4831864 1.7016292 ] [ 1.2209569 2.9384928 2.3344845 ] [ 1.9813573 4.5123314 4.0957271 ] [ 5.1241382 2.1821031 3.084727 ] [ 2.8774143 2.1588373 4.2297238 ] [ 3.620949 4.024197 2.2427174 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.87366398706688e-12 2.31562587004224e-12 4.507723922620799e-12 ] [ 1.081437175507584e-11 -1.11639666937344e-12 -5.0901151242816e-13 ] [ 3.9806078143776e-12 5.530072824353281e-12 5.180317668032641e-12 ] [ -4.097566707696e-12 4.1312124167328e-12 -2.04581932709952e-12 ] [ -5.341496636085119e-12 -2.15076189576192e-12 -6.80876998541376e-12 ] [ -8.2295802127392e-12 -8.709752545992962e-12 -3.24440765712e-13 ] ] "source-value" [ [ 0.0017936 0.0014453 0.0028135 ] [ 0.0067498 -0.0006968 -0.0003177 ] [ 0.0024845 0.0034516 0.0032333 ] [ -0.0025575 0.0025785 -0.0012769 ] [ -0.0033339 -0.0013424 -0.0042497 ] [ -0.0051365 -0.0054362 -0.0002025 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.169887218133351e-18 "source-value" -19.78488 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.354018828406471e-09 -8.819341907508665e-09 -4.042641850087707e-09 ] [ -3.085775669241606e-09 -2.536388184445651e-10 -2.356273090911936e-10 ] [ -2.254138176559826e-09 2.599145763117711e-09 1.496225321737144e-09 ] [ 8.23817108377993e-09 -5.495901601384858e-09 2.508628231443022e-09 ] [ -9.33135702044784e-10 -3.53104170089332e-09 6.277867292944961e-09 ] [ 3.888974526904186e-10 1.550077810489604e-08 -6.004451847163889e-09 ] ] "source-value" [ [ -1.469263 -5.5046003 -2.5232186 ] [ -1.9259897 -0.1583089 -0.147067 ] [ -1.4069224 1.6222592 0.9338704 ] [ 5.141862 -3.430272 1.5657626 ] [ -0.5824175 -2.2039029 3.9183366 ] [ 0.2427307 9.6748248 -3.7476841 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.678169279714781e-18 "source-value" -16.715818 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.966654e-10 1.561504e-10 1.979713e-10 ] [ 1.215751e-10 3.296566e-10 1.975446e-10 ] [ 1.823708e-10 4.192867e-10 4.123573e-10 ] [ 5.205541e-10 2.34853e-10 2.95907e-10 ] [ 3.135824e-10 2.260061e-10 4.318186e-10 ] [ 3.662306e-10 3.63962e-10 2.333021e-10 ] ] "source-value" [ [ 2.966654 1.561504 1.979713 ] [ 1.215751 3.296566 1.975446 ] [ 1.823708 4.192867 4.123573 ] [ 5.205541 2.34853 2.95907 ] [ 3.135824 2.260061 4.318186 ] [ 3.662306 3.63962 2.333021 ] ] } "instance-id" 1 }