{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6136317 0.272403 0.5113261 ] [ 1.058649 2.716721 0.3297698 ] [ 0.0311528 1.744123 2.343307 ] [ 2.175185 1.227279 1.696033 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.136317e-11 2.72403e-11 5.113261e-11 ] [ 1.058649e-10 2.716721e-10 3.297698e-11 ] [ 3.11528e-12 1.744123e-10 2.343307e-10 ] [ 2.175185e-10 1.227279e-10 1.696033e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1804118 -11.2638603 -6.7894085 ] [ 0.674606 10.1346176 -6.7064415 ] [ -8.1880537 2.5693821 9.0292711 ] [ 11.6938595 -1.4401394 4.4665789 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.697758051276446e-09 -1.804669363261727e-08 -1.08778315677608e-08 ] [ 1.080837961451405e-09 1.623744737946821e-08 -1.074490378006288e-08 ] [ -1.311870820799494e-08 4.116603930522008e-09 1.44664870592851e-08 ] [ 1.873562829781998e-08 -2.30735767737294e-09 7.156248288538582e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6922067 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.71121401230112e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.785914 -0.4653891 0.2130242 ] [ 1.5462712 3.2464866 0.0139718 ] [ -0.1501103 1.8199698 3.093442 ] [ 1.6965436 1.3594586 1.5599979 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.85914e-11 -4.653891e-11 2.130242e-11 ] [ 1.5462712e-10 3.2464866e-10 1.39718e-12 ] [ -1.501103e-11 1.8199698e-10 3.093442e-10 ] [ 1.6965436e-10 1.3594586e-10 1.5599979e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.8e-06 -9e-07 2.6e-06 ] [ 4e-07 3.2e-06 -7e-07 ] [ -3.5e-06 -1.2e-06 7e-07 ] [ 5e-06 -1.2e-06 -2.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.88391791744e-15 -1.44195895872e-15 4.16565921408e-15 ] [ 6.408706483200001e-16 5.126965186560001e-15 -1.12152363456e-15 ] [ -5.6076181728e-15 -1.92261194496e-15 1.12152363456e-15 ] [ 8.010883104e-15 -1.92261194496e-15 -4.16565921408e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.1471636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465537166655276e-18 } }