{ "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" [ [ 1.593193 1.569284 2.84459 ] [ 1.603337 4.216737 3.188357 ] [ 3.675145 1.205287 1.773064 ] [ 3.545696 2.526378 4.008338 ] [ 3.206595 3.44318 2.117333 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.593193e-10 1.569284e-10 2.84459e-10 ] [ 1.603337e-10 4.216737e-10 3.188357e-10 ] [ 3.675145e-10 1.205287e-10 1.773064e-10 ] [ 3.545696e-10 2.526378e-10 4.008338e-10 ] [ 3.206595e-10 3.44318e-10 2.117333e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5210515 -2.4123762 0.9018177 ] [ -12.2281315 7.4054928 5.4819367 ] [ 3.2704653 -4.3852049 -3.7249492 ] [ 6.0106169 -5.6245978 15.0917265 ] [ 8.4681007 5.0166861 -17.7505317 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.84569970841065e-09 -3.865052780057711e-09 1.444871247067622e-09 ] [ -1.959162656677937e-08 1.186490752741523e-08 8.783030889807067e-09 ] [ 5.239863085967799e-09 -7.025872826082305e-09 -5.968026571076992e-09 ] [ 9.630069953105513e-09 -9.011599170807805e-09 2.41796115650186e-08 ] [ 1.356739307589904e-08 8.037617249532587e-09 -2.843948713081629e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2062775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.739199526619934e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9094591 1.7650083 3.234695 ] [ 1.0182473 4.1641477 2.5831225 ] [ 3.2047362 1.1586652 1.014498 ] [ 3.9514051 2.4537071 4.7614063 ] [ 3.5401183 3.4193378 2.3379601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9094591e-10 1.7650083e-10 3.234695e-10 ] [ 1.0182473e-10 4.1641477e-10 2.5831225e-10 ] [ 3.2047362e-10 1.1586652e-10 1.014498e-10 ] [ 3.9514051e-10 2.4537071e-10 4.7614063e-10 ] [ 3.5401183e-10 3.4193378e-10 2.3379601e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.54e-05 -5.33e-05 6.92e-05 ] [ 1.5e-06 -2.63e-05 -5.11e-05 ] [ -3.71e-05 2.82e-05 -2.04e-05 ] [ 1.9e-06 -5.6e-06 -1.3e-06 ] [ 6.91e-05 5.71e-05 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.671705284359999e-14 -8.53960145922e-14 1.108706230728e-13 ] [ 2.403264951e-15 -4.21372454742e-14 -8.187122599739999e-14 ] [ -5.94407531214e-14 4.51813810788e-14 -3.26844033336e-14 ] [ 3.0441356046e-15 -8.972189150399999e-15 -2.0828296242e-15 ] [ 1.107104054094e-13 9.148428580139999e-14 5.767835882399999e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725931241282e-18 } }