data_dataset_pos int64 0 1.96M | mace_mp_energy float64 -2,613.03 16k | mace_omat_energy float64 -2,613.03 16k | orb_energy float64 -2,562.33 1.93k | uma_energy float64 -2,615.15 1.19k | immutable_id stringlengths 4 13 | true_energy float64 -2,617.15 5.19k | nsites int64 1 444 | species_at_sites stringlengths 5 1.85k | formation_energy float64 -904.18 5.21k | formation_energy_per_atom float64 -5.46 651 |
|---|---|---|---|---|---|---|---|---|---|---|
1,962,985 | -29.185276 | -29.185274 | -29.32853 | -29.318714 | agm004947782 | -29.292594 | 10 | ['Cs' 'Cs' 'Cs' 'Cs' 'Cs' 'Cs' 'Pt' 'Br' 'Br' 'O'] | -9.809804 | -0.98098 |
1,962,986 | -19.515318 | -19.515316 | -19.42456 | -19.411526 | agm004759864 | -19.85604 | 7 | ['K' 'K' 'Cu' 'I' 'Br' 'Br' 'Br'] | -6.969647 | -0.995664 |
1,962,987 | -15.149797 | -15.149797 | -15.157752 | -15.130503 | agm001597357 | -15.621937 | 5 | ['Ir' 'Cu' 'Br' 'Br' 'In'] | 3.433641 | 0.686728 |
1,962,988 | -49.222427 | -49.222427 | -49.079857 | -49.094933 | agm004674852 | -49.925516 | 15 | ['Rb' 'Rb' 'Rb' 'Tb' 'Cu' 'Cu' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br'] | -18.995835 | -1.266389 |
1,962,989 | -29.227068 | -29.227072 | -28.828152 | -29.129642 | agm001698691 | -29.29137 | 5 | ['Nb' 'O' 'Br' 'F' 'F'] | -8.636492 | -1.727298 |
1,962,990 | -17.405918 | -17.40592 | -17.353727 | -17.408249 | agm001459117 | -17.68386 | 5 | ['Se' 'Br' 'Pt' 'F' 'F'] | -2.634773 | -0.526955 |
1,962,991 | -61.592304 | -61.5923 | -61.520367 | -61.527157 | agm004662241 | -62.089931 | 12 | ['Rb' 'Rb' 'Rb' 'Ta' 'Br' 'Br' 'F' 'F' 'F' 'F' 'F' 'F'] | -32.354432 | -2.696203 |
1,962,992 | -14.337997 | -14.337997 | -14.201874 | -14.335273 | agm001791239 | -14.544126 | 5 | ['Rh' 'Se' 'Se' 'Br' 'F'] | 3.373771 | 0.674754 |
1,962,993 | -37.251583 | -37.251583 | -37.1791 | -37.15637 | agm004564735 | -37.644629 | 9 | ['Ti' 'Tl' 'Tl' 'Br' 'Br' 'Br' 'Br' 'F' 'F'] | -14.493783 | -1.61042 |
1,962,994 | -11.198123 | -11.198123 | -11.109684 | -11.128189 | agm001780156 | -11.197631 | 5 | ['I' 'Sb' 'Sb' 'Ga' 'Br'] | 3.312153 | 0.662431 |
1,962,995 | -15.452545 | -15.452545 | -15.448405 | -15.496895 | agm001684375 | -15.684889 | 5 | ['Ru' 'Ga' 'Se' 'Br' 'Br'] | 3.458292 | 0.691658 |
1,962,996 | -19.39315 | -19.393148 | -19.41821 | -19.38777 | agm005196680 | -19.558128 | 4 | ['La' 'Pr' 'Ge' 'Br'] | -3.550322 | -0.88758 |
1,962,997 | -57.01581 | -57.015804 | -56.80822 | -56.90908 | agm004594055 | -57.491459 | 12 | ['Pr' 'Pr' 'Pr' 'Pr' 'Pr' 'Pr' 'Tl' 'Ge' 'Ge' 'Br' 'Br' 'Br'] | -12.162113 | -1.013509 |
1,962,998 | -21.955832 | -21.955833 | -21.872204 | -21.98341 | agm001435859 | -22.020097 | 5 | ['Ru' 'Ge' 'S' 'S' 'Br'] | 1.807304 | 0.361461 |
1,962,999 | -93.406204 | -93.406204 | -93.351585 | -93.54404 | agm004714896 | -93.864514 | 16 | ['La' 'La' 'La' 'La' 'La' 'La' 'La' 'La' 'H' 'Ir' 'Ir' 'Ir' 'Br' 'Br' 'Br'
'Br'] | -17.762961 | -1.110185 |
1,963,000 | -41.207703 | -41.207703 | -40.48458 | -41.12181 | agm005007925 | -41.362711 | 10 | ['Mg' 'Mg' 'H' 'H' 'H' 'H' 'Br' 'Br' 'N' 'N'] | -4.539655 | -0.453965 |
1,963,001 | -23.150196 | -23.150196 | -21.87212 | -22.824986 | agm001427116 | -21.845756 | 5 | ['H' 'Nb' 'Mn' 'Br' 'Br'] | 4.260021 | 0.852004 |
1,963,002 | -39.93471 | -39.934715 | -39.845974 | -39.868683 | agm004684737 | -40.401786 | 15 | ['Na' 'Na' 'Na' 'Tl' 'Tl' 'Tl' 'Hg' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br'] | -15.59933 | -1.039955 |
1,963,003 | -68.57831 | -68.57831 | -68.563515 | -68.52154 | agm005085831 | -69.113902 | 18 | ['U' 'U' 'Hg' 'Hg' 'Pb' 'Pb' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br' 'Br' 'Br'] | -18.418841 | -1.023269 |
1,963,004 | -72.32376 | -72.32376 | -72.319084 | -72.3456 | agm005070307 | -72.979571 | 18 | ['Rb' 'Rb' 'Pu' 'Pu' 'Hg' 'Hg' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br' 'Br' 'Br' 'Br'] | -21.597281 | -1.199849 |
1,963,005 | -28.121555 | -28.121555 | -28.076166 | -28.082836 | agm005070309 | -28.288539 | 9 | ['Rb' 'Tb' 'Hg' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -12.299065 | -1.366563 |
1,963,006 | -10.948416 | -10.948416 | -10.745052 | -10.841421 | agm001793001 | -10.944323 | 5 | ['S' 'Se' 'Se' 'Hg' 'Br'] | 2.140856 | 0.428171 |
1,963,007 | -8.653172 | -8.653172 | -8.612032 | -8.601468 | agm001606244 | -9.423448 | 5 | ['Tl' 'Se' 'Hg' 'Hg' 'Br'] | -1.283947 | -0.256789 |
1,963,008 | -11.010996 | -11.010996 | -11.024253 | -10.967382 | agm001799334 | -10.767163 | 5 | ['I' 'K' 'Te' 'Te' 'Br'] | -0.146541 | -0.029308 |
1,963,009 | -21.403313 | -21.403313 | -21.50557 | -21.56502 | agm001702551 | -21.45391 | 5 | ['I' 'I' 'Tc' 'Br' 'N'] | 2.027893 | 0.405579 |
1,963,010 | -34.737167 | -34.737167 | -34.75873 | -34.758667 | agm004956241 | -35.1334 | 10 | ['K' 'Nd' 'In' 'In' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -13.71426 | -1.371426 |
1,963,011 | -75.03185 | -75.03185 | -74.96219 | -74.97135 | agm005085619 | -75.713021 | 18 | ['Pm' 'Pm' 'Mn' 'Mn' 'In' 'In' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br' 'Br' 'Br' 'Br'] | -22.294424 | -1.238579 |
1,963,012 | -17.26635 | -17.266354 | -17.038046 | -17.29155 | agm001592202 | -17.520815 | 5 | ['N' 'N' 'Rh' 'Br' 'In'] | 10.94073 | 2.188146 |
1,963,013 | -47.99215 | -47.99215 | -47.95503 | -47.99698 | agm004813901 | -48.192437 | 8 | ['La' 'La' 'La' 'La' 'P' 'Ir' 'Br' 'Br'] | -10.860197 | -1.357525 |
1,963,014 | -97.6794 | -97.6794 | -97.73719 | -97.853355 | agm004715526 | -98.423779 | 16 | ['Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Pm' 'Ir' 'Ir' 'Ir' 'Os' 'Br' 'Br'
'Br' 'Br'] | -15.914585 | -0.994662 |
1,963,015 | -47.462902 | -47.4629 | -47.463814 | -47.520386 | agm004684670 | -47.554128 | 15 | ['Na' 'Na' 'Na' 'Li' 'Li' 'Li' 'Mg' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br'] | -22.810108 | -1.520674 |
1,963,016 | -35.74827 | -35.74827 | -35.68258 | -35.78656 | agm005216673 | -35.83771 | 8 | ['Li' 'Li' 'Nd' 'Nd' 'Se' 'Se' 'Br' 'Br'] | -12.149645 | -1.518706 |
1,963,017 | -74.43258 | -74.43258 | -74.53229 | -74.55626 | agm004924849 | -74.762955 | 20 | ['Rb' 'Rb' 'Rb' 'Rb' 'Li' 'Li' 'Sc' 'Sc' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -34.128564 | -1.706428 |
1,963,018 | -19.834213 | -19.834213 | -19.886286 | -19.852097 | agm001531601 | -20.073692 | 5 | ['Ru' 'Li' 'Br' 'Br' 'Ta'] | 6.31441 | 1.262882 |
1,963,019 | -40.861343 | -40.861343 | -40.915035 | -40.924168 | agm004908050 | -41.104558 | 12 | ['Rb' 'Tm' 'Mg' 'Mg' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -19.0206 | -1.58505 |
1,963,020 | -17.285633 | -17.285633 | -17.29928 | -17.339748 | agm001685001 | -17.435134 | 5 | ['Sr' 'Mg' 'Se' 'Br' 'Br'] | -7.312096 | -1.462419 |
1,963,021 | -21.832554 | -21.832554 | -21.80008 | -21.825247 | agm001792098 | -21.996221 | 5 | ['Mn' 'Se' 'Se' 'Br' 'Rb'] | -3.158249 | -0.63165 |
1,963,022 | -19.696674 | -19.696674 | -19.525768 | -19.570126 | agm001792105 | -19.785652 | 5 | ['Sb' 'Mn' 'Se' 'Se' 'Br'] | 2.163134 | 0.432627 |
1,963,023 | -15.035144 | -15.035145 | -14.731022 | -14.703441 | agm001503603 | -14.856917 | 5 | ['Te' 'Br' 'Br' 'Pt' 'N'] | 6.032717 | 1.206543 |
1,963,024 | -87.79776 | -87.79777 | -87.871735 | -87.90779 | agm004924895 | -88.235692 | 20 | ['Rb' 'Rb' 'Rb' 'Rb' 'Na' 'Na' 'Pu' 'Pu' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'
'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -32.754387 | -1.637719 |
1,963,025 | -12.965582 | -12.965582 | -12.892823 | -12.907146 | agm001430309 | -13.125226 | 5 | ['Na' 'Zn' 'Tc' 'Br' 'Br'] | 3.198877 | 0.639775 |
1,963,026 | -26.07359 | -26.07359 | -26.107506 | -26.130766 | agm001597430 | -26.140005 | 5 | ['Ru' 'Nb' 'Br' 'Br' 'Zr'] | 5.224375 | 1.044875 |
1,963,027 | -66.183136 | -66.18313 | -66.12414 | -66.21447 | agm004626555 | -66.43643 | 12 | ['Nd' 'Nd' 'Nd' 'Nd' 'Nd' 'Nd' 'P' 'Pt' 'Pt' 'Br' 'Br' 'Br'] | -15.285819 | -1.273818 |
1,963,028 | -34.79331 | -34.79331 | -34.84609 | -34.852715 | agm004955414 | -35.158601 | 10 | ['Rb' 'Nd' 'Tl' 'Tl' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br'] | -14.604435 | -1.460444 |
1,963,029 | -16.280178 | -16.280178 | -16.309864 | -16.421135 | agm001792599 | -16.310557 | 5 | ['O' 'Sb' 'Se' 'Se' 'Br'] | 1.42687 | 0.285374 |
1,963,030 | -14.089685 | -14.089687 | -14.126915 | -14.134584 | agm001763967 | -14.274018 | 5 | ['Pb' 'P' 'P' 'S' 'Br'] | 6.054815 | 1.210963 |
1,963,031 | -9.775763 | -9.775764 | -9.86775 | -9.854137 | agm001549047 | -10.122896 | 5 | ['Pb' 'Zn' 'Zn' 'Si' 'Br'] | 3.231268 | 0.646254 |
1,963,032 | -16.231869 | -16.231869 | -16.209429 | -16.225138 | agm001685763 | -16.239246 | 5 | ['Tl' 'Se' 'Br' 'Br' 'Pt'] | -0.980165 | -0.196033 |
1,963,033 | -34.141693 | -34.141693 | -33.935017 | -33.862152 | agm004481123 | -33.915613 | 10 | ['Sb' 'Br' 'Br' 'Br' 'Br' 'Br' 'Br' 'Tc' 'Rb' 'Rb'] | -7.351956 | -0.735196 |
1,963,034 | -56.040844 | -56.040844 | -55.88053 | -56.07198 | agm004770826 | -56.405687 | 8 | ['U' 'U' 'Rh' 'S' 'S' 'S' 'S' 'Br'] | -8.276828 | -1.034603 |
1,963,035 | -24.695004 | -24.695004 | -24.790533 | -24.901371 | agm001546449 | -25.424926 | 5 | ['Tl' 'Rh' 'Rh' 'Br' 'V'] | 2.435713 | 0.487143 |
1,963,036 | -17.204662 | -17.204662 | -17.242615 | -17.232895 | agm001686758 | -17.459393 | 5 | ['Y' 'Zn' 'Se' 'Br' 'Br'] | -2.88372 | -0.576744 |
1,963,037 | -269.6553 | -269.6553 | -268.48172 | -271.44122 | mp-1203505 | -271.344043 | 44 | ['Ca' 'Ca' 'Ca' 'Ca' 'C' 'C' 'C' 'C' 'C' 'C' 'C' 'C' 'Cl' 'Cl' 'Cl' 'Cl'
'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'
'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'] | -43.241131 | -0.982753 |
1,963,038 | -19.795235 | -19.795233 | -18.881897 | -20.192514 | agm001748672 | -19.238531 | 5 | ['Ca' 'C' 'O' 'O' 'N'] | 10.256231 | 2.051246 |
1,963,039 | -27.161757 | -27.161757 | -26.983599 | -27.021933 | agm001486333 | -27.02676 | 5 | ['Y' 'Ca' 'C' 'C' 'N'] | 8.250558 | 1.650112 |
1,963,040 | -23.653503 | -23.6535 | -23.710037 | -23.965916 | agm001522934 | -24.103809 | 5 | ['Tl' 'Co' 'Co' 'C' 'Pd'] | 6.904102 | 1.38082 |
1,963,041 | -87.89925 | -87.89925 | -86.06063 | -88.091385 | agm004560485 | -88.62863 | 9 | ['Np' 'Np' 'Sc' 'Cr' 'Cr' 'C' 'C' 'C' 'C'] | -0.158493 | -0.01761 |
1,963,042 | -13.215487 | -13.215487 | -13.177631 | -13.175777 | agm001744801 | -13.203195 | 5 | ['Cs' 'I' 'C' 'O' 'O'] | 8.349394 | 1.669879 |
1,963,043 | -36.902172 | -36.902172 | -36.224197 | -36.916267 | agm005213035 | -37.022581 | 4 | ['Dy' 'U' 'C' 'N'] | -3.545436 | -0.886359 |
1,963,044 | -69.32595 | -69.32594 | -69.29995 | -69.38009 | agm004688380 | -70.219054 | 15 | ['Er' 'Er' 'Er' 'Er' 'Er' 'Er' 'Er' 'Er' 'Hg' 'Hg' 'Hg' 'C' 'Se' 'Se' 'Se'] | -13.085667 | -0.872378 |
1,963,045 | -83.792564 | -83.79256 | -83.20716 | -83.96427 | agm005031777 | -84.333734 | 12 | ['Er' 'Er' 'Er' 'Er' 'Er' 'Er' 'C' 'C' 'S' 'S' 'O' 'O'] | -20.309478 | -1.692456 |
1,963,046 | -45.93741 | -45.93741 | -46.280003 | -46.305504 | agm004984146 | -47.14047 | 10 | ['Er' 'Er' 'Er' 'Er' 'Er' 'Er' 'Tl' 'Pb' 'Pb' 'C'] | -0.737942 | -0.073794 |
1,963,047 | -71.70252 | -71.70253 | -70.48145 | -71.83737 | agm004560612 | -71.783472 | 9 | ['Er' 'Tm' 'Tm' 'Tc' 'Tc' 'C' 'C' 'C' 'C'] | -0.605464 | -0.067274 |
1,963,048 | -17.43572 | -17.43572 | -17.220596 | -17.548536 | agm001694941 | -17.676889 | 5 | ['C' 'N' 'Se' 'F' 'F'] | 7.216952 | 1.44339 |
1,963,049 | -25.403336 | -25.403336 | -24.855072 | -24.726824 | agm001737061 | -25.515526 | 5 | ['C' 'Te' 'Fe' 'N' 'N'] | 12.01539 | 2.403078 |
1,963,050 | -31.722635 | -31.722633 | -31.605822 | -31.748098 | agm005011857 | -31.999757 | 5 | ['Pm' 'Y' 'Y' 'In' 'C'] | -2.331851 | -0.46637 |
1,963,051 | -17.690128 | -17.690126 | -17.481256 | -17.634293 | agm001421772 | -17.851766 | 5 | ['Sr' 'S' 'C' 'C' 'In'] | 9.176433 | 1.835287 |
1,963,052 | -15.461284 | -15.461285 | -15.652838 | -15.658006 | agm001446570 | -15.715833 | 5 | ['K' 'C' 'Tl' 'Tl' 'Mo'] | 10.20997 | 2.041994 |
1,963,053 | -17.466776 | -17.466776 | -17.397474 | -17.503723 | agm001507513 | -18.168793 | 5 | ['Ni' 'Ni' 'Si' 'C' 'La'] | 12.980306 | 2.596061 |
1,963,054 | -18.221745 | -18.221743 | -18.061037 | -18.173979 | agm001506556 | -18.105629 | 5 | ['P' 'C' 'Li' 'Li' 'Na'] | 1.702798 | 0.34056 |
1,963,055 | -32.055836 | -32.055836 | -31.88924 | -32.091896 | agm001658714 | -32.161931 | 5 | ['Y' 'Y' 'Mg' 'C' 'Pt'] | -2.33461 | -0.466922 |
1,963,056 | -82.396095 | -82.396095 | -81.13093 | -82.49354 | agm004579286 | -82.557938 | 11 | ['Na' 'Na' 'Pa' 'C' 'C' 'N' 'N' 'N' 'N' 'N' 'N'] | -1.862508 | -0.169319 |
1,963,057 | -79.62302 | -79.62301 | -77.77312 | -79.609665 | agm004861915 | -79.578673 | 8 | ['Zr' 'Pa' 'Nb' 'Nb' 'C' 'C' 'C' 'C'] | -4.213706 | -0.526713 |
1,963,058 | -88.69122 | -88.69122 | -87.01808 | -88.62036 | agm004878373 | -88.619369 | 12 | ['Rb' 'Ta' 'C' 'C' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'] | -17.619496 | -1.468291 |
1,963,059 | -37.26418 | -37.26418 | -36.999332 | -37.14714 | agm001485870 | -37.246037 | 5 | ['Sr' 'C' 'C' 'Os' 'W'] | 7.096486 | 1.419297 |
1,963,060 | -37.607365 | -37.60737 | -37.44049 | -37.641342 | agm001618902 | -37.989886 | 5 | ['Sc' 'Sc' 'C' 'Sn' 'Zr'] | -3.534981 | -0.706996 |
1,963,061 | -9.571214 | -9.571214 | -9.569187 | -9.554499 | agm001327176 | -9.889909 | 4 | ['Ca' 'Cd' 'Li' 'Er'] | -0.493293 | -0.123323 |
1,963,062 | -8.536627 | -8.536628 | -8.483853 | -8.491694 | agm001531747 | -9.03925 | 5 | ['I' 'Ni' 'Ca' 'Ca' 'Cd'] | 3.213647 | 0.642729 |
1,963,063 | -35.70625 | -35.70625 | -35.90695 | -35.716747 | agm005136881 | -38.17976 | 20 | ['K' 'K' 'K' 'K' 'Ca' 'Ca' 'Tl' 'Tl' 'Tl' 'Tl' 'Tl' 'Tl' 'Tl' 'Tl' 'Tl'
'Tl' 'Cd' 'Cd' 'Cd' 'Cd'] | -2.408911 | -0.120446 |
1,963,064 | -8.62858 | -8.62858 | -8.644032 | -8.638083 | agm005003722 | -8.896844 | 5 | ['Sr' 'Li' 'Li' 'Ca' 'Cd'] | -0.467465 | -0.093493 |
1,963,065 | -9.831307 | -9.831308 | -9.874827 | -9.843177 | agm001597727 | -10.40935 | 5 | ['Na' 'Ca' 'Mn' 'Cd' 'Cd'] | 3.93201 | 0.786402 |
1,963,066 | -11.256218 | -11.25622 | -11.253386 | -11.2361 | agm001328608 | -11.690931 | 4 | ['Tl' 'Nd' 'Ca' 'Cd'] | -1.638547 | -0.409637 |
1,963,067 | -81.95289 | -81.95289 | -81.11197 | -81.50835 | agm004682274 | -82.351478 | 15 | ['Ca' 'Ca' 'Ca' 'Cd' 'Cd' 'Cd' 'P' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'] | -28.521126 | -1.901408 |
1,963,068 | -77.83795 | -77.83794 | -76.620514 | -77.87023 | agm004712696 | -78.955956 | 16 | ['Ca' 'Ca' 'Ca' 'Zn' 'Cd' 'Cd' 'Cd' 'Cd' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'] | -28.346401 | -1.77165 |
1,963,069 | -16.416214 | -16.416214 | -16.386883 | -16.373255 | agm005194206 | -16.864196 | 4 | ['Ca' 'Sm' 'Cd' 'Rh'] | -1.875326 | -0.468832 |
1,963,070 | -38.133728 | -38.13373 | -38.065536 | -38.065636 | agm005100314 | -38.281049 | 9 | ['Cs' 'Ca' 'Mn' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl' 'Cl'] | -15.154079 | -1.683787 |
1,963,071 | -15.84823 | -15.848232 | -15.839468 | -15.848681 | agm005213436 | -15.960789 | 4 | ['K' 'Ca' 'Se' 'Cl'] | -7.507676 | -1.876919 |
1,963,072 | -36.764626 | -36.764626 | -36.77575 | -36.813393 | agm004543619 | -36.983631 | 7 | ['Ca' 'La' 'La' 'P' 'P' 'Cl' 'Cl'] | -10.602683 | -1.514669 |
1,963,073 | -21.042213 | -21.042213 | -21.232632 | -21.316236 | agm001476659 | -21.093822 | 5 | ['Ca' 'Cl' 'Cl' 'Os' 'V'] | 4.957923 | 0.991585 |
1,963,074 | -40.973083 | -40.973083 | -40.811684 | -40.796257 | agm004490799 | -41.22843 | 11 | ['Sr' 'Sr' 'Ca' 'Ca' 'Ca' 'Ca' 'Sb' 'Sb' 'Sb' 'Cl' 'Cl'] | -13.766603 | -1.251509 |
1,963,075 | -459.20813 | -459.20813 | -444.715 | -458.64117 | agm003281464 | -459.410544 | 56 | ['Li' 'Li' 'Li' 'Li' 'Li' 'Li' 'Li' 'Li' 'Ti' 'Ti' 'Ti' 'Ti' 'Ti' 'Ti'
'Ti' 'Ti' 'Ti' 'Ti' 'Ti' 'Ti' 'Nb' 'Nb' 'Nb' 'Nb' 'O' 'O' 'O' 'O' 'O' 'O'
'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'
'O' 'O' 'O' 'O' 'O' 'O' 'O' 'O'] | -149.887083 | -2.676555 |
1,963,076 | -109.50928 | -109.50928 | -107.76181 | -109.220634 | agm005055849 | -109.579565 | 14 | ['Ca' 'Ca' 'Pm' 'Pm' 'Cr' 'Cr' 'N' 'N' 'N' 'N' 'N' 'N' 'N' 'N'] | -10.021976 | -0.715855 |
1,963,077 | -21.526363 | -21.526363 | -21.26267 | -21.59114 | agm001775651 | -19.245631 | 5 | ['Cr' 'Ca' 'S' 'S' 'P'] | 6.077442 | 1.215488 |
1,963,078 | -49.38922 | -49.38922 | -49.620815 | -49.612568 | agm004573600 | -49.720281 | 11 | ['Cs' 'Cs' 'Ca' 'P' 'P' 'S' 'S' 'S' 'S' 'S' 'S'] | -10.423012 | -0.947547 |
1,963,079 | -30.690355 | -30.690355 | -30.681599 | -30.79024 | agm004545979 | -31.899442 | 7 | ['Ca' 'Dy' 'Dy' 'Cu' 'Cu' 'Ge' 'Ge'] | -3.245596 | -0.463657 |
1,963,080 | -41.086143 | -41.086143 | -40.872288 | -40.904175 | agm004563259 | -41.753738 | 9 | ['Ca' 'Ca' 'Dy' 'Cu' 'Cu' 'Se' 'Se' 'Se' 'Se'] | -10.990029 | -1.221114 |
1,963,081 | -20.589464 | -20.589464 | -20.413498 | -20.585423 | agm005002919 | -21.773641 | 5 | ['Ca' 'Cu' 'Cu' 'Ni' 'Ge'] | -1.172282 | -0.234456 |
1,963,082 | -19.344847 | -19.344847 | -19.251724 | -19.294075 | agm005198590 | -19.415185 | 4 | ['Ca' 'Dy' 'Te' 'Se'] | -6.173436 | -1.543359 |
1,963,083 | -13.627317 | -13.627316 | -13.610709 | -13.592136 | agm001393606 | -13.943192 | 4 | ['Tl' 'Ca' 'Sm' 'Dy'] | -0.249165 | -0.062291 |
1,963,084 | -23.600998 | -23.600998 | -23.650654 | -23.634378 | agm001404397 | -23.920879 | 4 | ['Ca' 'Gd' 'In' 'Er'] | -0.520446 | -0.130112 |
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