{ "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" [ [ 2.304566 2.573407 2.013286 ] [ 1.594988 1.205897 3.788304 ] [ 4.305804 2.27362 1.126873 ] [ 3.775257 0.6680547 2.70197 ] [ 5.174566 3.086819 3.056932 ] [ 3.543793 4.723705 1.740813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.304566e-10 2.573407e-10 2.013286e-10 ] [ 1.594988e-10 1.205897e-10 3.788304e-10 ] [ 4.305804000000001e-10 2.27362e-10 1.126873e-10 ] [ 3.775257e-10 6.680547000000001e-11 2.70197e-10 ] [ 5.174566e-10 3.086819000000001e-10 3.056932e-10 ] [ 3.543793e-10 4.723705e-10 1.740813e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3384339 0.5493167 0.0201339 ] [ 0.8245395 -0.0753955 -0.3284257 ] [ 0.8405768 0.177622 -0.9326693 ] [ -0.3976793 0.636357 0.6675886 ] [ -0.3728134 0.2405179 -0.0762327 ] [ 0.4438104 -1.528418 0.6496052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.144407520733492e-09 8.801023814059877e-10 3.22580641312926e-11 ] [ 1.321057920710043e-09 -1.20796908408747e-10 -5.261959825450937e-10 ] [ 1.346752508042491e-09 2.845818180843479e-10 -1.494300959709136e-09 ] [ -6.371524822854763e-10 1.019556316282338e-09 1.069594856044772e-09 ] [ -5.973129183220955e-10 3.853521594387486e-10 -1.221382506867318e-10 ] [ 7.110626528061935e-10 -2.448795606585012e-09 1.040782272764897e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.622468 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.502995319501271e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7845345 2.9219119 1.7303535 ] [ 1.8829467 1.1941411 3.2805553 ] [ 3.9354586 2.1230624 1.2018242 ] [ 4.1869259 0.9053267 3.2012911 ] [ 5.2734731 3.0061253 3.0084686 ] [ 3.6356353 4.3809353 2.0056854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7845345e-10 2.9219119e-10 1.7303535e-10 ] [ 1.8829467e-10 1.1941411e-10 3.2805553e-10 ] [ 3.9354586e-10 2.1230624e-10 1.2018242e-10 ] [ 4.1869259e-10 9.053267000000001e-11 3.2012911e-10 ] [ 5.273473100000001e-10 3.0061253e-10 3.0084686e-10 ] [ 3.6356353e-10 4.3809353e-10 2.0056854e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.03e-05 1.53e-05 1.26e-05 ] [ 1.09e-05 -2.84e-05 -1.96e-05 ] [ -4.26e-05 -2.43e-05 2.73e-05 ] [ -1.3e-05 2.19e-05 -1.26e-05 ] [ -2.45e-05 3.37e-05 -9.3e-06 ] [ 2.88e-05 -1.81e-05 1.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.456771835019998e-14 2.45133025002e-14 2.01874255884e-14 ] [ 1.74637253106e-14 -4.550181640559999e-14 -3.140266202639999e-14 ] [ -6.82527246084e-14 -3.893289220619999e-14 4.37394221082e-14 ] [ -2.082829624199999e-14 3.50876682846e-14 -2.01874255884e-14 ] [ -3.925332753299999e-14 5.399335256579999e-14 -1.49002426962e-14 ] [ 4.614268705919999e-14 -2.899939707539999e-14 2.5634826144e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.017216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.726458585093095e-18 } }