{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0068438 -1.1713506 -1.3533509 ] [ 0.5092185 -0.0842117 3.6817028 ] [ 0.8546976 -0.3650661 -1.7658144 ] [ -1.5374027 -1.8968075 1.7602215 ] [ 0.5567848 3.9586194 -1.9479014 ] [ -1.7439289 0.2296308 -1.3659071 ] [ 2.3674746 -0.6708143 0.9910496 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.613141610447769e-09 -1.87671056154188e-09 -2.16830718958287e-09 ] [ 8.158579823005289e-10 -1.349220180494178e-10 5.898738199492375e-09 ] [ 1.369376523855878e-09 -5.849003752855074e-10 -2.829146571660729e-09 ] [ -2.463190682988512e-09 -3.039020655695954e-09 2.820185757964431e-09 ] [ 8.920675967263631e-10 6.342407505579099e-09 -3.120882108415887e-09 ] [ -2.794082134937322e-09 3.679091022067272e-10 -2.188424439834701e-09 ] [ 3.793112485708496e-09 -1.074762997213066e-09 1.587836512255046e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.955140005765543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.876730577743618e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5902584 0.793361 2.7105387 ] [ 2.8229535 2.3164389 0.8883773 ] [ 1.1399139 2.7989705 2.5096716 ] [ 2.3624245 2.3576929 4.6255887 ] [ 2.509397 4.4692829 3.5238798 ] [ 4.2385799 3.4833605 2.3192782 ] [ 4.5054257 1.7090263 3.8004192 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5902584e-10 7.93361e-11 2.7105387e-10 ] [ 2.8229535e-10 2.3164389e-10 8.883773000000001e-11 ] [ 1.1399139e-10 2.7989705e-10 2.5096716e-10 ] [ 2.3624245e-10 2.3576929e-10 4.6255887e-10 ] [ 2.509397e-10 4.4692829e-10 3.5238798e-10 ] [ 4.238579900000001e-10 3.4833605e-10 2.3192782e-10 ] [ 4.5054257e-10 1.7090263e-10 3.8004192e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 -1.9e-05 1.63e-05 ] [ 1.2e-06 -2.3e-05 -1.65e-05 ] [ -1.4e-05 -1.1e-06 3.3e-06 ] [ -3.35e-05 -1.42e-05 -4e-06 ] [ 5.1e-06 2.63e-05 2.91e-05 ] [ 3.54e-05 3.42e-05 -2.07e-05 ] [ 1.35e-05 -3.1e-06 -7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.23367600818e-14 -3.0441356046e-14 2.61154791342e-14 ] [ 1.9226119608e-15 -3.6850062582e-14 -2.6435914461e-14 ] [ -2.243047287599999e-14 -1.7623942974e-15 5.2871828922e-15 ] [ -5.367291723899999e-14 -2.27509082028e-14 -6.408706535999999e-15 ] [ 8.1711008334e-15 4.21372454742e-14 4.66233400494e-14 ] [ 5.671705284359999e-14 5.479444088279999e-14 -3.316505632379999e-14 ] [ 2.162938455899999e-14 -4.9667475654e-15 -1.2016324755e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.557919005765545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.293741747470206e-18 } }