{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1546295 -0.5715521 -1.6473329 ] [ -3.9863206 -5.4909353 1.7335981 ] [ -0.2709383 0.0310727 -0.3653103 ] [ -0.1626496 0.2448952 -0.2412082 ] [ 0.1395708 -0.2301134 0.0622684 ] [ -0.2667374 0.4484104 0.6942678 ] [ 4.7017045 5.5682225 -0.2362828 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.477437697859936e-10 -9.157274121891437e-10 -2.639318259054665e-09 ] [ -6.386789668333429e-09 -8.797448163985434e-09 2.7775303456833e-09 ] [ -4.340910099392967e-10 4.978395348513216e-11 -5.852916219974343e-10 ] [ -2.605933865024717e-10 3.923653639861402e-10 -3.864581387852506e-10 ] [ 2.236170727063526e-10 -3.686823096127987e-10 9.976497469462272e-11 ] [ -4.27360426172978e-10 7.184326594035763e-10 1.11233963773425e-09 ] [ 7.532961027810154e-09 8.921275908912528e-09 -3.785667780571622e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.103979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.900577189725416e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9761017 1.6798948 2.4878933 ] [ 3.2596976 1.5212911 4.5482456 ] [ 3.1500857 4.741431 3.2126765 ] [ 1.5823821 3.253212 4.2243757 ] [ 4.3348201 1.1974654 2.47607 ] [ 3.5392367 3.1863175 1.4962563 ] [ 3.702832 3.7228452 5.2634023 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9761017e-10 1.6798948e-10 2.4878933e-10 ] [ 3.2596976e-10 1.5212911e-10 4.548245600000001e-10 ] [ 3.1500857e-10 4.741431e-10 3.2126765e-10 ] [ 1.5823821e-10 3.253212e-10 4.224375700000001e-10 ] [ 4.3348201e-10 1.1974654e-10 2.47607e-10 ] [ 3.5392367e-10 3.1863175e-10 1.4962563e-10 ] [ 3.702832e-10 3.7228452e-10 5.263402300000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-06 3.92e-05 7.5e-06 ] [ 1.09e-05 3.4e-05 -4.38e-05 ] [ -1.03e-05 -3.03e-05 -6.6e-06 ] [ -1.68e-05 -4.2e-06 1.39e-05 ] [ 6.1e-06 -1.75e-05 -1.34e-05 ] [ 6.4e-06 -2.52e-05 4.57e-05 ] [ -5.3e-06 4e-06 -3.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-14 6.280532353535999e-14 1.2016324656e-14 ] [ 1.746372516672e-14 5.44740051072e-14 -7.017533599104001e-14 ] [ -1.650241919424e-14 -4.854595161024e-14 -1.057436569728e-14 ] [ -2.691656722944e-14 -6.72914180736e-15 2.227025502912e-14 ] [ 9.77327738688e-15 -2.8038090864e-14 -2.146916671872e-14 ] [ 1.025393037312e-14 -4.037485084416e-14 7.321947157056e-14 ] [ -8.491536090240001e-15 6.4087064832e-15 -5.28718284864e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.037892 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.370641871331535e-18 } }