{ "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" [ [ 2.6598268 -1.847687 -14.2796497 ] [ 11.2205655 3.2493785 9.3134372 ] [ -7.8430699 -3.1244722 0.2915191 ] [ -6.2057301 8.8130878 1.9590945 ] [ 0.1684077 -7.0903071 2.7155989 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.26151234944699e-09 -2.960320938345558e-09 -2.287852109104511e-08 ] [ 1.797732786436652e-08 5.206078307721968e-09 1.492177146406638e-08 ] [ -1.256598333260871e-08 -5.005956352422575e-09 4.670650903847093e-10 ] [ -9.942675763130483e-09 1.412012334655046e-08 3.138815431697913e-09 ] [ 2.698188819256818e-10 -1.13599243635043e-08 4.350869104896102e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7617125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.424751237325724e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.97072 2.0486886 1.7739585 ] [ 2.8352696 3.1395273 4.8136437 ] [ 0.4270952 2.3340042 3.0421677 ] [ 0.7758858 4.435412 4.3181951 ] [ 3.7554636 2.6456849 3.086831 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.97072e-10 2.0486886e-10 1.7739585e-10 ] [ 2.8352696e-10 3.1395273e-10 4.8136437e-10 ] [ 4.270952e-11 2.3340042e-10 3.0421677e-10 ] [ 7.758858e-11 4.435412000000001e-10 4.3181951e-10 ] [ 3.7554636e-10 2.6456849e-10 3.086831e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.04e-05 2.97e-05 5.61e-05 ] [ -1.35e-05 4.65e-05 9.91e-05 ] [ 1.03e-05 -2.3e-05 -4.64e-05 ] [ 4.08e-05 -2.15e-05 -7.8e-06 ] [ -6.8e-05 -3.16e-05 -0.0001009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.870616967359999e-14 4.75846460298e-14 8.988210916739999e-14 ] [ -2.162938455899999e-14 7.450121348099999e-14 1.587757044294e-13 ] [ 1.65024193302e-14 -3.6850062582e-14 -7.43409958176e-14 ] [ 6.53688066672e-14 -3.4446797631e-14 -1.24969777452e-14 ] [ -1.08948011112e-13 -5.06287816344e-14 -1.616596223706e-13 ] ] } "relaxed-potential-energy" { "source-value" -11.295169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.809685584888114e-18 } }