{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.887739 1.995765 3.859098 ] [ 2.327199 3.871069 1.984027 ] [ 1.151407 3.535975 3.566474 ] [ 2.937456 4.643275 4.143131 ] [ 3.294842 1.915913 1.493263 ] [ 5.055976 2.713207 3.11233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.887739e-10 1.995765e-10 3.859098e-10 ] [ 2.327199e-10 3.871069e-10 1.984027e-10 ] [ 1.151407e-10 3.535975e-10 3.566474e-10 ] [ 2.937456e-10 4.643275e-10 4.143131e-10 ] [ 3.294842e-10 1.915913e-10 1.493263e-10 ] [ 5.055976000000001e-10 2.713207e-10 3.11233e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5924121 -16.4445535 12.4770153 ] [ 2.8978543 15.4521331 -19.9318074 ] [ -15.704935 -2.8926136 8.1746247 ] [ 5.1860448 9.1083504 5.2060243 ] [ 1.9144521 -6.5687671 -5.3324994 ] [ 3.1141716 1.3454508 -0.5933575 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.153502058099033e-09 -2.634707915719482e-08 1.99903822110239e-08 ] [ 4.642874409944749e-09 2.475704639430983e-08 -3.193427582656844e-08 ] [ -2.516207968818365e-08 -4.634477882928123e-09 1.309719257815421e-08 ] [ 8.308959732981412e-09 1.459318606493433e-08 8.340970420776685e-09 ] [ 3.067290396261464e-09 -1.052432507510021e-08 -8.543605869110027e-09 ] [ 4.98945293067933e-09 2.155649816196657e-09 -9.50663514276336e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 8.8698169 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.421101326795673e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.6574481 1.4350239 4.3002035 ] [ 2.3273677 3.8380151 0.8072762 ] [ 0.8633237 4.0387409 4.0766229 ] [ 2.5350938 4.8250881 4.3360543 ] [ 3.0784871 2.1396478 0.9517519 ] [ 5.1928985 2.3986881 3.6864142 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.6574481e-10 1.4350239e-10 4.3002035e-10 ] [ 2.3273677e-10 3.8380151e-10 8.072762e-11 ] [ 8.633237000000001e-11 4.0387409e-10 4.0766229e-10 ] [ 2.5350938e-10 4.825088100000001e-10 4.3360543e-10 ] [ 3.0784871e-10 2.1396478e-10 9.517519e-11 ] [ 5.1928985e-10 2.3986881e-10 3.686414200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5576156 0.9775753 -0.6226497 ] [ -0.0661165 0.149497 -0.0127173 ] [ -0.0264382 -0.0124357 -0.0041028 ] [ 0.0264382 0.0124357 0.0041028 ] [ 0.0661165 -0.149497 0.0127173 ] [ -1.5576156 -0.9775753 0.6226497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.495575298513364e-09 1.566248290731546e-09 -9.975947922881337e-10 ] [ -1.059303105491232e-10 2.395205982797376e-10 -2.037536073969984e-11 ] [ -4.235866593603456e-11 -1.992418780328256e-11 -6.573410239818241e-12 ] [ 4.235866593603456e-11 1.992418780328256e-11 6.573410239818241e-12 ] [ 1.059303105491232e-10 -2.395205982797376e-10 2.037536073969984e-11 ] [ -2.495575298513364e-09 -1.566248290731546e-09 9.975947922881337e-10 ] ] } "relaxed-potential-energy" { "source-value" -32.304201 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.175703559582398e-18 } }