{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.5373295 -3.2877133 -1.9212166 ] [ -1.5091893 -2.6315121 3.4446027 ] [ 3.3469167 4.3750936 -1.6239533 ] [ 0.4484383 1.7426286 1.4546344 ] [ 2.392137 -2.7023454 -4.7618393 ] [ 2.5993977 2.8404368 3.3241871 ] [ -1.7403709 -0.3365882 0.0835851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.871779866566155e-09 -5.267497385153217e-09 -3.078128320012865e-09 ] [ -2.417987812821517e-09 -4.216147163972312e-09 5.518861913884556e-09 ] [ 5.362351688505087e-09 7.009672679731706e-09 -2.601860010531009e-09 ] [ 7.184773601312967e-10 2.791998801657435e-09 2.330581227491436e-09 ] [ 3.83262597515065e-09 -4.329634621206424e-09 -7.629307598466638e-09 ] [ 4.164694223101292e-09 4.550881433819966e-09 5.325934854784952e-09 ] [ -2.788381567500655e-09 -5.392737448771546e-10 1.339180930672301e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.792062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.209731928902409e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2961153 2.3205298 2.4256124 ] [ 2.1867982 1.2456456 4.7234466 ] [ 2.52553 4.5090618 1.9958073 ] [ 2.1118081 3.8334724 4.4215165 ] [ 3.6796781 1.3636218 2.590137 ] [ 4.4229504 2.738358 4.7104238 ] [ 4.8121879 3.6387466 2.3601773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2961153e-10 2.3205298e-10 2.4256124e-10 ] [ 2.1867982e-10 1.2456456e-10 4.7234466e-10 ] [ 2.52553e-10 4.5090618e-10 1.9958073e-10 ] [ 2.1118081e-10 3.8334724e-10 4.4215165e-10 ] [ 3.6796781e-10 1.3636218e-10 2.590137e-10 ] [ 4.4229504e-10 2.738358e-10 4.7104238e-10 ] [ 4.8121879e-10 3.6387466e-10 2.3601773e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.87e-05 5.8e-06 -9e-07 ] [ -6.7e-06 2.8e-06 1.13e-05 ] [ -3.48e-05 2.47e-05 1.61e-05 ] [ 9.7e-06 -2.14e-05 -4.09e-05 ] [ 2.65e-05 2.48e-05 2.3e-06 ] [ 7.1e-06 8e-07 1.52e-05 ] [ 1.7e-05 -3.73e-05 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.996070280896e-14 9.292624400640001e-15 -1.44195895872e-15 ] [ -1.073458335936e-14 4.48609453824e-15 1.810459581504e-14 ] [ -5.575574640383999e-14 3.957376253376001e-14 2.579504359488e-14 ] [ 1.554111322176e-14 -3.428657968511999e-14 -6.552902379072e-14 ] [ 4.24576804512e-14 3.973398019584e-14 3.68500622784e-15 ] [ 1.137545400768e-14 1.28174129664e-15 2.435308463616e-14 ] [ 2.72370025536e-14 -5.976118795584e-14 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.272513 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767361651106407e-18 } }