{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -48.4562301 -39.9083701 -42.8539465 ] [ 10.7004962 -11.6164962 5.6485803 ] [ -52.5289082 9.5289396 -38.4610727 ] [ -6.2027023 -17.1248065 23.7072015 ] [ 38.8060813 10.1784792 18.4583072 ] [ 47.9583144 41.5133806 -20.8848177 ] [ 9.7229488 7.4288734 54.3857478 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.763543899832524e-08 -6.394025754845375e-08 -6.865959119131399e-08 ] [ 1.714408484259924e-08 -1.861167862725204e-08 9.05002329737145e-09 ] [ -8.41605886341894e-08 1.526704424813531e-08 -6.162143149082913e-08 ] [ -9.937824610842389e-09 -2.743696461002387e-08 3.798312398789469e-08 ] [ 6.217419620372407e-08 1.630772140953909e-08 2.957346825538431e-08 ] [ 7.683769010465598e-08 6.651176784769228e-08 -3.346116664861003e-08 ] [ 1.557788125259541e-08 1.190236728036301e-08 8.713557362988503e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 29.02723 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.650674927258439e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1788472 3.3062225 2.1797768 ] [ 4.5860505 1.0062576 1.804712 ] [ 3.3918342 3.0573223 0.4995129 ] [ 4.1891992 1.7943991 4.5655788 ] [ 6.3326684 2.9739479 3.0155133 ] [ 4.4933661 4.8231532 2.2232461 ] [ 2.8519774 4.1293064 4.2547995 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1788472e-10 3.3062225e-10 2.1797768e-10 ] [ 4.5860505e-10 1.0062576e-10 1.804712e-10 ] [ 3.3918342e-10 3.0573223e-10 4.995129e-11 ] [ 4.1891992e-10 1.7943991e-10 4.5655788e-10 ] [ 6.3326684e-10 2.9739479e-10 3.0155133e-10 ] [ 4.4933661e-10 4.8231532e-10 2.2232461e-10 ] [ 2.8519774e-10 4.1293064e-10 4.2547995e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.49e-05 -1.2e-05 1.53e-05 ] [ 6.9e-06 2.33e-05 -2.23e-05 ] [ -9.8e-06 -2.27e-05 -2.9e-06 ] [ -2.08e-05 7.5e-06 -2.05e-05 ] [ 2.64e-05 -2.84e-05 3.02e-05 ] [ -1.97e-05 1.33e-05 -1.36e-05 ] [ 2.1e-06 1.9e-05 1.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.387243164992e-14 -1.92261194496e-14 2.451330229824e-14 ] [ 1.105501868352e-14 3.733071526464e-14 -3.572853864384e-14 ] [ -1.570133088384e-14 -3.636940929216e-14 -4.646312200320001e-15 ] [ -3.332527371264e-14 1.2016324656e-14 -3.28446207264e-14 ] [ 4.229746278912e-14 -4.550181603071999e-14 4.838573394816e-14 ] [ -3.156287942976e-14 2.130894905664e-14 -2.178960204288e-14 ] [ 3.36457090368e-15 3.04413557952e-14 2.194981970496e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.447223 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.115788603008404e-18 } }