vasp 5.4.4 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complex MareNostrum4 2022-08-03T19:40:57.000 8.59015027 8.59015027 28.811456621 90.0 90.0 90.0 3354.196600000001 AuxInfo=1/0/N:1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46;47;48;49;50;51;52;53;54;55;56;57;58;59;60;61;62;63;64;65;66;67/rA:67CuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuO4OO4O4OOO4O4O1O4O4O1O4OO4O4O1O4O4/rB:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;s21s31s35s40;s10s25;s9s22s23s24;s6s7s8s39;s16s38;s28s48;s36s38s47s48;s29s30s34s37;s33;s1s31s32s33;s42s43s44s45;s1;s3s28s35s46;s2s34;s2s25s27s41;s11s12s13s14;s32;s10s18s19s20;s7s14s37s43;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;; 1 450 0.1E-05 -.3E-01 2 0.3000 0.0 642.0000 -1.0000 0 0.03 T 3 PE 8 0 false F 0.0000 2 PAW_PBE Cu 05Jan2001|PAW_PBE O 08Apr2002 Cu O 63.546 16.000 11.000 6.000 48 19 K-Spacing 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