{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.7056683e-10 1.9188551e-10 2.400088e-10 ] [ 2.3784903e-10 2.7385478e-10 4.5412697e-10 ] [ 1.9958086e-10 4.3680948e-10 2.7019857e-10 ] [ 3.9083101e-10 1.7174735e-10 1.8346038e-10 ] [ 4.5552302e-10 2.5045929e-10 3.894585800000001e-10 ] [ 3.7530632e-10 3.8457829e-10 1.0240456e-10 ] [ 4.4210183e-10 4.664365e-10 3.1665964e-10 ] ] "source-value" [ [ 1.7056683 1.9188551 2.400088 ] [ 2.3784903 2.7385478 4.5412697 ] [ 1.9958086 4.3680948 2.7019857 ] [ 3.9083101 1.7174735 1.8346038 ] [ 4.5552302 2.5045929 3.8945858 ] [ 3.7530632 3.8457829 1.0240456 ] [ 4.4210183 4.664365 3.1665964 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.184480402991359e-12 1.69878787103424e-12 -1.73099162111232e-12 ] [ -1.36697709286656e-12 -1.23784165723008e-12 -2.28854908515072e-12 ] [ -2.56732781716992e-12 4.77753046556352e-12 4.018258964966401e-13 ] [ -2.15076189576192e-12 2.51077098245568e-12 2.22798680888448e-12 ] [ 2.69454064086144e-12 1.377871893888e-14 1.3810762471296e-12 ] [ -4.1143895622144e-12 -3.7603085290176e-12 -8.010883104e-15 ] [ 3.205955418220801e-13 -4.00287806940672e-12 1.666263685632e-14 ] ] "source-value" [ [ 0.0044842 0.0010603 -0.0010804 ] [ -0.0008532 -0.0007726 -0.0014284 ] [ -0.0016024 0.0029819 0.0002508 ] [ -0.0013424 0.0015671 0.0013906 ] [ 0.0016818 8.6e-06 0.000862 ] [ -0.002568 -0.002347 -5e-06 ] [ 0.0002001 -0.0024984 1.04e-05 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.314442822825441e-18 "source-value" -14.445616 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.181474759988182e-09 -7.595976877353487e-09 -6.860692844687661e-09 ] [ 5.11857298542025e-10 -2.702794253723491e-09 1.355629260383823e-08 ] [ -1.113103859960606e-08 9.94253340793092e-09 -4.529665090572007e-09 ] [ -7.222584969563847e-10 -2.41216390080491e-09 -2.964727059880952e-09 ] [ 7.647159531028577e-09 -4.395572039817786e-09 5.138090540797174e-09 ] [ 2.7378578890697e-09 -3.514441709142873e-10 -9.008866904771665e-09 ] [ 6.137897137910321e-09 7.515417674465378e-09 4.669568915494546e-09 ] ] "source-value" [ [ -3.2340222 -4.7410359 -4.2821077 ] [ 0.3194762 -1.6869515 8.4611724 ] [ -6.9474479 6.2056413 -2.8271946 ] [ -0.4507983 -1.5055543 -1.8504371 ] [ 4.7729816 -2.7435003 3.2069439 ] [ 1.7088365 -0.2193542 -5.6228925 ] [ 3.8309741 4.6907548 2.9145157 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.619274248608867e-18 "source-value" -10.106715 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] "source-value" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] } "instance-id" 1 }