{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3034186 -3.7933721 -7.5965034 ] [ -5.4916176 -2.2008205 17.5291153 ] [ -11.7569388 4.8006664 -1.2648092 ] [ 0.6342324 -25.3199493 -1.0808913 ] [ 7.3894882 1.8353821 -13.7753268 ] [ -0.430913 23.0869943 -1.2295702 ] [ 16.9591673 1.5910991 7.4179857 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.170136653283587e-08 -6.077652092615e-09 -1.217094014730771e-08 ] [ -8.798541329093806e-09 -3.526103151677367e-09 2.808473871696758e-08 ] [ -1.883669247753641e-08 7.6915154703401e-09 -2.026447730012751e-09 ] [ 1.016152323433874e-09 -4.056703080830133e-08 -1.731778770486119e-09 ] [ 1.183926523371747e-08 2.940606290854808e-09 -2.207050654283968e-08 ] [ -6.903987341987904e-10 3.698944251200287e-08 -1.96998862807238e-09 ] [ 2.717158135629586e-08 2.549221779395922e-09 1.188492326196872e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2966766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.679681554058434e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1188369 2.3465472 1.6439978 ] [ 2.8164064 2.5264781 4.9005283 ] [ 1.4013275 3.8659583 3.4216852 ] [ 2.6170597 0.7231903 3.3349197 ] [ 4.1837177 3.556883 1.5192618 ] [ 3.1392271 5.4610153 2.9612558 ] [ 4.7242569 3.696334 4.0427684 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1188369e-10 2.3465472e-10 1.6439978e-10 ] [ 2.8164064e-10 2.5264781e-10 4.900528300000001e-10 ] [ 1.4013275e-10 3.8659583e-10 3.4216852e-10 ] [ 2.6170597e-10 7.231903e-11 3.3349197e-10 ] [ 4.1837177e-10 3.556883e-10 1.5192618e-10 ] [ 3.1392271e-10 5.4610153e-10 2.9612558e-10 ] [ 4.7242569e-10 3.696334e-10 4.0427684e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -2.57e-05 -5.17e-05 ] [ 3.6e-06 4.48e-05 4.91e-05 ] [ -1.83e-05 -1.47e-05 1.68e-05 ] [ -1.15e-05 -2.38e-05 -1.51e-05 ] [ -8.4e-06 3.9e-06 -4.32e-05 ] [ 1.48e-05 2e-05 1.62e-05 ] [ 1.43e-05 -4.5e-06 2.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -4.117593915456e-14 -8.283253129536002e-14 ] [ 5.76783583488e-15 7.177751261183999e-14 7.866687208128001e-14 ] [ -2.931983216064e-14 -2.355199632576e-14 2.691656722944e-14 ] [ -1.84250311392e-14 -3.813180357504e-14 -2.419286697408e-14 ] [ -1.345828361472e-14 6.24848882112e-15 -6.921403001856e-14 ] [ 2.371221398784e-14 3.2043532416e-14 2.595526125696e-14 ] [ 2.291112567744e-14 -7.2097947936e-15 4.454051005824e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }