{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1737692 -0.351129 1.0232605 ] [ -0.0674741 0.6823039 -0.062046 ] [ 0.7787303 -0.8047161 -0.5558642 ] [ -0.2530185 1.15027 0.1614211 ] [ -1.5023623 -0.2108879 1.2493417 ] [ -0.7478106 -0.5150604 -0.4210258 ] [ 0.618166 0.0492196 -1.3950872 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.880585570455119e-09 -5.625706746848833e-10 1.639444050088118e-09 ] [ -1.081054255295213e-10 1.093171356860661e-09 -9.940865061415681e-11 ] [ 1.24766348056857e-09 -1.289297321801355e-09 -8.905926255796954e-10 ] [ -4.053803253298847e-10 1.842935701607616e-09 2.586251125238189e-10 ] [ -2.407049753031316e-09 -3.378796629896083e-10 2.001666063130527e-09 ] [ -1.19812466010642e-09 -8.252177311798963e-10 -6.745576935136167e-10 ] [ 9.904111129734528e-10 7.885849240512767e-11 -2.235176095817334e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.065858085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.292292925139484e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.547654 2.2147551 2.1948175 ] [ 2.2300345 2.8263523 4.5203693 ] [ 2.0633528 0.6127105 3.9504058 ] [ 3.754724 0.1304464 2.4808743 ] [ 4.9667331 2.0460282 2.142618 ] [ 4.2680587 1.5163354 4.4041398 ] [ 4.0244489 3.7121816 3.4031273 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.547654e-10 2.2147551e-10 2.1948175e-10 ] [ 2.2300345e-10 2.8263523e-10 4.5203693e-10 ] [ 2.0633528e-10 6.127105000000001e-11 3.9504058e-10 ] [ 3.754724e-10 1.304464e-11 2.4808743e-10 ] [ 4.9667331e-10 2.0460282e-10 2.142618e-10 ] [ 4.2680587e-10 1.5163354e-10 4.4041398e-10 ] [ 4.0244489e-10 3.7121816e-10 3.4031273e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.99e-05 -5.7e-06 7.6e-06 ] [ 1.41e-05 -1.87e-05 6.7e-06 ] [ -1.51e-05 2.51e-05 -8.4e-06 ] [ -1.37e-05 7.3e-06 -1.31e-05 ] [ -4.2e-06 1.56e-05 2.74e-05 ] [ 2.61e-05 -9.4e-06 2.09e-05 ] [ -2.7e-05 -1.42e-05 -4.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.188331475392e-14 -9.13240673856e-15 1.217654231808e-14 ] [ 2.259069035328e-14 -2.996070280896e-14 1.073458335936e-14 ] [ -2.419286697408e-14 4.021463318208e-14 -1.345828361472e-14 ] [ -2.194981970496e-14 1.169588933184e-14 -2.098851373248e-14 ] [ -6.72914180736e-15 2.499395528448e-14 4.389963940992e-14 ] [ 4.181680980288e-14 -1.506046023552e-14 3.348549137472e-14 ] [ -4.32587687616e-14 -2.275090801536e-14 -6.600967677696001e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }