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non-adiabatic molecular dynamics
Started by sergio |
1 Replies
2976 Views |
August 16, 2016, 19:42by Ulrik G. Vej-Hansen |
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E_in-plane
Started by Dipankar Saha |
8 Replies
5490 Views |
August 16, 2016, 15:04 by Petr Khomyakov |
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SRH recomb.
Started by Dipankar Saha |
4 Replies
3664 Views |
August 16, 2016, 14:18 by Dipankar Saha |
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Optimize Geometry
Started by Sunnyvale |
3 Replies
3237 Views |
August 16, 2016, 01:07 by Petr Khomyakov |
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Approximate spectral method
Started by Dipankar Saha |
1 Replies
2801 Views |
August 15, 2016, 14:52 by Jess Wellendorff |
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Restarting a IETS run
Started by Sabyasachi Sen |
1 Replies
2718 Views |
August 15, 2016, 14:35 by Jess Wellendorff |
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Unusual transmission pathway
Started by yasheng |
1 Replies
2843 Views |
August 11, 2016, 22:37 by Anders Blom |
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Creating ions using Builder
Started by anuppanindre |
3 Replies
4049 Views |
August 11, 2016, 20:15 by anuppanindre |
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2 Replies
3530 Views |
August 11, 2016, 12:00 by berlin |
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surface to volume ratio
Started by SAKINA |
1 Replies
2863 Views |
August 10, 2016, 14:51 by Anders Blom |
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Export POSCAR: Cartesian and Direct
Started by markmick |
1 Replies
4590 Views |
August 10, 2016, 14:09 by Umberto Martinez |
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determine magnetic moment of TM metals.
Started by keshavdev |
1 Replies
2791 Views |
August 9, 2016, 13:31 by zh |
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ion bombarment graphene nanoribbon
Started by zuriana auzar |
1 Replies
2996 Views |
August 8, 2016, 10:13 by Umberto Martinez |
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Eigen State Calculation error
Started by Parveen |
3 Replies
3811 Views |
August 7, 2016, 22:48 by Anders Blom |
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Solvent-Water-reg
Started by GJK |
9 Replies
6725 Views |
August 7, 2016, 13:32 by zh |
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1 Replies
5051 Views |
August 5, 2016, 22:05 by Umberto Martinez |
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3 Replies
3722 Views |
August 4, 2016, 19:37 by Anders Blom |
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structure of graphene
Started by tomar.shalini758 |
1 Replies
2866 Views |
August 4, 2016, 13:53 by Ulrik G. Vej-Hansen |
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4 Replies
4354 Views |
August 4, 2016, 10:47 by Anders Blom |
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Computational Chemistry Importer?
Started by markmick |
1 Replies
3574 Views |
August 3, 2016, 22:18 by Umberto Martinez |
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