{ "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" [ [ 2.487281 5.921696 4.58109 ] [ 2.384555 3.657598 3.132891 ] [ 3.419185 2.494172 4.950415 ] [ 4.429689 2.154563 3.12196 ] [ 4.178368 4.562199 4.289341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.487281e-10 5.921696e-10 4.58109e-10 ] [ 2.384555e-10 3.657598e-10 3.132891e-10 ] [ 3.419185e-10 2.494172e-10 4.950414999999999e-10 ] [ 4.429689e-10 2.154563e-10 3.12196e-10 ] [ 4.178368e-10 4.562199e-10 4.289341000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6327976 1.269945 0.0355386 ] [ -1.1160183 -0.0968492 -1.1216823 ] [ -1.8042465 -0.8921467 4.4137427 ] [ 1.6772219 -0.8777062 -3.7306713 ] [ 2.8758404 0.5967571 0.4030722 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.61603014121835e-09 2.034676188701856e-09 5.693911405596288e-11 ] [ -1.78805842864496e-09 -1.551695239831833e-10 -1.797133157025172e-09 ] [ -2.890721560460228e-09 -1.429376585063871e-09 7.071595364166669e-09 ] [ 2.687205716073755e-09 -1.406240353571209e-09 -5.977194336749543e-09 ] [ 4.60760425403212e-09 9.561102739164077e-10 6.457928553344217e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.310867 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.812200666837823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6657586 5.5437015 4.1332873 ] [ 1.9717806 3.4408921 3.2423812 ] [ 3.2690149 2.5387087 5.093527 ] [ 4.2921348 2.7906004 2.935815 ] [ 4.7003891 4.4763252 4.6706865 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6657586e-10 5.543701500000001e-10 4.1332873e-10 ] [ 1.9717806e-10 3.4408921e-10 3.2423812e-10 ] [ 3.2690149e-10 2.5387087e-10 5.093527e-10 ] [ 4.292134800000001e-10 2.7906004e-10 2.935815e-10 ] [ 4.7003891e-10 4.4763252e-10 4.670686500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0092032 -0.232694 -0.2312428 ] [ 0.4239562 0.2152164 0.3781538 ] [ -0.024318 0.1259913 0.0959441 ] [ 0.0317378 0.3463568 -0.0559542 ] [ -0.4405792 -0.4548705 -0.1869009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474515187654656e-11 -3.728168866004352e-10 -3.704918078883302e-10 ] [ 6.79252711883209e-10 3.448146844927411e-10 6.05869177426679e-10 ] [ -3.89617310646144e-11 2.01860315284199e-10 1.537193939236973e-10 ] [ 5.084956115562623e-11 5.549247674151015e-10 -8.964851107556736e-11 ] [ -7.058856938507675e-10 -7.287828805916064e-10 -2.994482523864787e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.153174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.267588449291442e-18 } }