Materials-Design
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2021-04-02
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Materials-Design-main.zip （50个子文件） 
Materials-Design-main Sintering ptn-tio2 
ptn-tio2.xyz 398KB PES 6KB code INIT 4KB dist.py 947B PES 6KB param.py 932B data-Ebind-Radius.py 578B autoinit.py 6KB DATA 75KB sintering.py 14KB plot.py 2KB README.md 5KB Cluster-energies 3KB Scaling-Relationships Ptn-graphene-ORR POSCAR-pt5oh-C72-pbe.vasp 4KB POSCAR-pt5-C72-pbe0.vasp 4KB POSCAR-pt5-2ooh-C72-pbe.vasp 4KB POSCAR-pt5-2oh-C72-pbe0.vasp 4KB POSCAR-pt5-C72-pbe.vasp 4KB POSCAR-pt5-2o-C72-pbe0.vasp 4KB POSCAR-pt5oh-C72-pbe0.vasp 4KB POSCAR-pt5-2o-C72-pbe.vasp 4KB test 1B pt-gas-clusters-GM.xyz 29KB README.md 2KB POSCAR-pt5ooh-C72-pbe.vasp 4KB POSCAR-pt5o-C72-pbe.vasp 4KB POSCAR-pt5-2ooh-C72-pbe0.vasp 4KB POSCAR-pt5-2oh-C72-pbe.vasp 4KB POSCAR-pt5ooh-C72-pbe0.vasp 4KB POSCAR-pt5o-C72-pbe0.vasp 4KB test 1B README.md 19B PES-NanoCluster test 1B Pt4Sn3-Al2O3 test 1B README.md 724B pt4sn3-al2o3.xyz 69KB c2h4-pt4sn3-al2o3.xyz 172KB Pt4Snx-SiO2 pt4sn3-sio2.xyz 49KB sio2f.xyz 9KB co-pt4-sio2.xyz 113KB 2co-pt4-sio2.xyz 114KB test 1B 2co-pt4sn3-sio2.xyz 132KB sio2-annealed.xyz 66KB README.md 948B pt4-sio2.xyz 48KB co-pt4sn3-sio2.xyz 98KB XANES Readme.md 12B Cu5Ox-Al2O3-UNCD README.md 544B all-coords.xyz 199KB资源评论
