{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.9892961 -5.2095203 3.8809826 ] [ -0.5002733 -0.5574961 -5.2691321 ] [ -1.4624375 0.691023 -0.0789553 ] [ 3.7780525 6.2312095 1.7500908 ] [ 2.1739544 -1.1552161 -0.282986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.391556944868619e-09 -8.346571630243003e-09 6.218019587451598e-09 ] [ -8.015261852704647e-10 -8.932072176071791e-10 -8.442080262526809e-09 ] [ -2.3430831718812e-09 1.107140895035079e-09 -1.265003357482503e-10 ] [ 6.053107387654991e-09 9.983498180206857e-09 2.803954564037168e-09 ] [ 3.483058914365291e-09 -1.850860227391755e-09 -4.533935532137088e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.423314 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.509781338125733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3445377 2.1851981 3.7918725 ] [ 1.7621399 3.014813 1.3850588 ] [ 0.9334299 4.6020565 3.1710039 ] [ 3.2185113 5.0266609 3.7137992 ] [ 3.6766111 2.7888045 3.0219526 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3445377e-10 2.1851981e-10 3.7918725e-10 ] [ 1.7621399e-10 3.014813e-10 1.3850588e-10 ] [ 9.334299e-11 4.6020565e-10 3.1710039e-10 ] [ 3.2185113e-10 5.0266609e-10 3.7137992e-10 ] [ 3.6766111e-10 2.7888045e-10 3.0219526e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 6.4e-06 6e-06 ] [ -1e-07 3.3e-06 1.1e-06 ] [ -1.15e-05 8.5e-06 -3.5e-06 ] [ -9.2e-06 -6.7e-06 2.6e-06 ] [ 2.07e-05 -1.15e-05 -6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 1.025393037312e-14 9.6130597248e-15 ] [ -1.6021766208e-16 5.28718284864e-15 1.76239428288e-15 ] [ -1.84250311392e-14 1.36185012768e-14 -5.6076181728e-15 ] [ -1.474002491136e-14 -1.073458335936e-14 4.16565921408e-15 ] [ 3.316505605055999e-14 -1.84250311392e-14 -9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.878088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.903079489340503e-18 } }