{ "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" [ [ 0.0317926 0.0463887 1.270674 ] [ 0.0111454 2.887791 2.968384 ] [ 2.5478 0.1715431 0.0845133 ] [ 1.93577 0.0052704 2.481441 ] [ 2.875434 2.93696 0.1676441 ] [ 2.282488 2.689422 2.770272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.17926e-12 4.63887e-12 1.270674e-10 ] [ 1.11454e-12 2.887791e-10 2.968384e-10 ] [ 2.5478e-10 1.715431e-11 8.451330000000001e-12 ] [ 1.93577e-10 5.270399999999999e-13 2.481441e-10 ] [ 2.875434e-10 2.93696e-10 1.676441e-11 ] [ 2.282488e-10 2.689422e-10 2.770272e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3030841 -0.0009223 -0.7244919 ] [ -0.3050585 0.0692727 0.064367 ] [ -0.6755939 0.8009173 1.4082022 ] [ 1.207067 0.9509148 -0.5965376 ] [ -0.2729284 -1.0008124 0.8523358 ] [ 0.3495978 -0.8193701 -1.0038755 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.855942591562093e-10 -1.47768749736384e-12 -1.160763984138971e-09 ] [ -4.887575966763168e-10 1.109871003996922e-10 1.031273025510336e-10 ] [ -1.082420751735093e-09 1.28321097325426e-09 2.256188642199126e-09 ] [ 1.933934527139194e-09 1.523533460932708e-09 -9.55758596148142e-10 ] [ -4.372795016323508e-10 -1.603478229086738e-09 1.365592491830865e-09 ] [ 5.601174218431143e-10 -1.312775618002558e-09 -1.60838585629391e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.119882 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.781601496645475e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3268777 -0.4604224 0.8481705 ] [ 0.1813107 3.5239024 3.2444996 ] [ 2.441887 0.3582542 0.1415061 ] [ 1.938277 0.16378 2.4776392 ] [ 2.6288609 2.670172 0.3758315 ] [ 2.1672168 2.4816889 2.6552813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.268777e-11 -4.604224e-11 8.481705000000001e-11 ] [ 1.813107e-11 3.5239024e-10 3.2444996e-10 ] [ 2.441887e-10 3.582542000000001e-11 1.415061e-11 ] [ 1.938277e-10 1.6378e-11 2.4776392e-10 ] [ 2.6288609e-10 2.670172e-10 3.758315e-11 ] [ 2.1672168e-10 2.4816889e-10 2.6552813e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.45e-05 1.48e-05 -1.8e-06 ] [ 1.68e-05 -1.68e-05 3e-07 ] [ -9e-06 -2.88e-05 3.12e-05 ] [ -7.7e-06 -1.86e-05 -2.47e-05 ] [ -2e-07 2.02e-05 -1.92e-05 ] [ -1.44e-05 2.92e-05 1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.32315610016e-14 2.371221398784e-14 -2.88391791744e-15 ] [ 2.691656722944e-14 -2.691656722944e-14 4.8065298624e-16 ] [ -1.44195895872e-14 -4.614268667904e-14 4.998791056896e-14 ] [ -1.233675998016e-14 -2.980048514688e-14 -3.957376253376001e-14 ] [ -3.2043532416e-16 3.236396774016e-14 -3.076179111936e-14 ] [ -2.307134333952e-14 4.678355732736e-14 2.291112567744e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.280897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.608487253905286e-18 } }