{ "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" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9923158 -4.9548569 -1.5634127 ] [ -5.6343166 0.9749093 1.6030932 ] [ -6.4688634 -4.6983171 0.1238233 ] [ 3.4378895 -1.363929 -0.0098609 ] [ 2.786652 -2.7502291 1.3377532 ] [ 7.6957539 4.4875872 -3.363243 ] [ 3.1752004 8.3048356 1.8718469 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.998571658410449e-09 -7.938555884589564e-09 -2.504863276601804e-09 ] [ -9.027170330705346e-09 1.561976887860493e-09 2.568438446003458e-09 ] [ -1.03642617026288e-08 -7.527533814724855e-09 1.983867963703047e-10 ] [ 5.508106181793801e-09 -2.185255156231123e-09 -1.579890344004672e-11 ] [ 4.464708684705562e-09 -4.406352765863825e-09 2.143316901440387e-09 ] [ 1.232995697801042e-08 7.189907295641334e-09 -5.388509304669254e-09 ] [ 5.087231847234809e-09 1.330581343790754e-08 2.999029340896955e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.109268 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.100336270540158e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4789692 2.6812504 0.2957244 ] [ 1.6200691 5.0506233 1.2322742 ] [ 2.1513318 3.0539304 2.8211688 ] [ 4.914616 2.3527991 0.9632706 ] [ 4.6425005 2.9159252 3.3565648 ] [ 4.1105369 4.7356771 0.5308596 ] [ 3.6285716 5.2264184 3.0109764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4789692e-10 2.6812504e-10 2.957244e-11 ] [ 1.6200691e-10 5.0506233e-10 1.2322742e-10 ] [ 2.1513318e-10 3.0539304e-10 2.8211688e-10 ] [ 4.914616e-10 2.3527991e-10 9.632706e-11 ] [ 4.6425005e-10 2.9159252e-10 3.3565648e-10 ] [ 4.1105369e-10 4.735677100000001e-10 5.308596e-11 ] [ 3.6285716e-10 5.2264184e-10 3.0109764e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 6.9e-06 -6.2e-06 ] [ -1.24e-05 5.5e-06 8e-07 ] [ 5.1e-06 -8.6e-06 -1.85e-05 ] [ -2.99e-05 -1.4e-06 -7.7e-06 ] [ 3.25e-05 -5e-07 2.81e-05 ] [ 1.54e-05 -1.87e-05 -1.85e-05 ] [ -1.54e-05 1.68e-05 2.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 1.105501868352e-14 -9.93349504896e-15 ] [ -1.986699009792e-14 8.8119714144e-15 1.28174129664e-15 ] [ 8.17110076608e-15 -1.377871893888e-14 -2.96402674848e-14 ] [ -4.790508096192e-14 -2.24304726912e-15 -1.233675998016e-14 ] [ 5.207074017599999e-14 -8.010883104e-16 4.502116304448e-14 ] [ 2.467351996032e-14 -2.996070280896e-14 -2.96402674848e-14 ] [ -2.467351996032e-14 2.691656722944e-14 3.52478856576e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.272513 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767361651106407e-18 } }