{ "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" [ [ 1.84187 2.347102 1.383115 ] [ 2.042679 1.03426 3.627522 ] [ 0.9834518 3.478775 3.226301 ] [ 4.103178 1.51668 2.106844 ] [ 3.482715 3.397853 2.716774 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84187e-10 2.347102e-10 1.383115e-10 ] [ 2.042679e-10 1.03426e-10 3.627522e-10 ] [ 9.834518e-11 3.478775e-10 3.226301e-10 ] [ 4.103178e-10 1.51668e-10 2.106844e-10 ] [ 3.482715e-10 3.397853e-10 2.716774e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 14.0984283 -64.8887075 -76.147753 ] [ 8.431343 -13.7357054 3.725401 ] [ -0.476991 15.0257634 35.3707903 ] [ -30.7261164 -105.8540856 -38.3696694 ] [ 8.6733361 169.4527351 75.4212311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.258817221228509e-08 -1.039631701104296e-07 -1.220021495830531e-07 ] [ 1.350850063654573e-08 -2.200702606207631e-08 5.968750385304941e-09 ] [ -7.642238285320128e-10 2.407392682915232e-08 5.667025327787942e-08 ] [ -4.922866534405946e-08 -1.695969411644819e-07 -6.147498726050516e-08 ] [ 1.389621632376065e-08 2.714932105078356e-07 1.208381331803739e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 34.856109 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.584564293185647e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6186467 2.2431438 0.6902866 ] [ 2.0637272 0.8702533 4.054319 ] [ 0.9328229 3.4291468 3.2566515 ] [ 4.0487466 1.2807166 1.9676041 ] [ 3.7899505 3.9514096 3.0916949 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6186467e-10 2.2431438e-10 6.902866e-11 ] [ 2.0637272e-10 8.702533e-11 4.054318999999999e-10 ] [ 9.328229e-11 3.4291468e-10 3.2566515e-10 ] [ 4.0487466e-10 1.2807166e-10 1.9676041e-10 ] [ 3.789950500000001e-10 3.9514096e-10 3.0916949e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 -7.9e-06 -2.9e-06 ] [ 1.63e-05 1.33e-05 -9e-07 ] [ -2.29e-05 4.6e-06 -5.6e-06 ] [ -6.1e-06 -3.9e-06 -9.8e-06 ] [ 1.38e-05 -6.2e-06 1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 -1.265719530432e-14 -4.646312200320001e-15 ] [ 2.611547891904e-14 2.130894905664e-14 -1.44195895872e-15 ] [ -3.668984461632e-14 7.370012455680001e-15 -8.972189076479999e-15 ] [ -9.77327738688e-15 -6.24848882112e-15 -1.570133088384e-14 ] [ 2.211003736704e-14 -9.93349504896e-15 3.076179111936e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }