{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2400939 -2.9097759 -5.123133 ] [ -5.1409592 -3.0468763 3.8350505 ] [ -4.7558587 8.4197182 -3.0497295 ] [ 3.0282194 -0.2048916 -1.376907 ] [ 5.2167704 -6.8649429 2.9200742 ] [ 2.0276341 1.7346187 -0.6348441 ] [ 3.864288 2.8721498 3.4294888 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.793379316576693e-09 -4.661974918747279e-09 -8.208163917848967e-09 ] [ -8.236724638726672e-09 -4.881633974329607e-09 6.14442825068735e-09 ] [ -7.61972562096828e-09 1.348987565376426e-08 -4.886205304664074e-09 ] [ 4.851742325333003e-09 -3.282725313183053e-10 -2.206048204415866e-09 ] [ 8.358187570961464e-09 -1.099885101750695e-08 4.678474614241264e-09 ] [ 3.24862795055685e-09 2.779165527142489e-09 -1.017132374872817e-09 ] [ 6.191271889637991e-09 4.601691260995396e-09 5.494646776655447e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3717447 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.501519025444631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2021188 2.255367 1.7727451 ] [ 2.1027924 2.7443727 4.2083724 ] [ 2.1040422 4.5342789 2.4827947 ] [ 4.4807659 2.384098 1.8271786 ] [ 4.3276685 1.6573068 3.9859052 ] [ 4.3864217 4.5763176 2.510208 ] [ 4.2295596 3.9362229 4.695944 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2021188e-10 2.255367e-10 1.7727451e-10 ] [ 2.1027924e-10 2.7443727e-10 4.2083724e-10 ] [ 2.1040422e-10 4.534278900000001e-10 2.4827947e-10 ] [ 4.4807659e-10 2.384098e-10 1.8271786e-10 ] [ 4.3276685e-10 1.6573068e-10 3.9859052e-10 ] [ 4.3864217e-10 4.5763176e-10 2.510208e-10 ] [ 4.2295596e-10 3.9362229e-10 4.695944e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 -4.4e-06 -1.4e-05 ] [ 8.8e-06 1.84e-05 -3.9e-06 ] [ -8.3e-06 -2.8e-06 -8.6e-06 ] [ -6.2e-06 8e-07 1.02e-05 ] [ 7.3e-06 -6.1e-06 1.06e-05 ] [ -9.4e-06 1.46e-05 -4.6e-06 ] [ 1.14e-05 -2.05e-05 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 -7.04957713152e-15 -2.24304726912e-14 ] [ 1.409915426304e-14 2.948004982272e-14 -6.24848882112e-15 ] [ -1.329806595264e-14 -4.48609453824e-15 -1.377871893888e-14 ] [ -9.93349504896e-15 1.28174129664e-15 1.634220153216e-14 ] [ 1.169588933184e-14 -9.77327738688e-15 1.698307218048e-14 ] [ -1.506046023552e-14 2.339177866368e-14 -7.370012455680001e-15 ] [ 1.826481347712e-14 -3.28446207264e-14 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }