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MGGA and DFT-U
Started by berna |
2 Replies
30074 Views |
March 24, 2017, 15:46by Petr Khomyakov |
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Type II Superlattice bandstructure
Started by swarnadipm |
1 Replies
14260 Views |
March 24, 2017, 12:40 by Jess Wellendorff |
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6 Replies
37867 Views |
March 24, 2017, 04:12 by wot19920302 |
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Optimize Geometry
Started by Inaoton |
2 Replies
22333 Views |
March 23, 2017, 09:20 by Jess Wellendorff |
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2 Replies
14969 Views |
March 22, 2017, 21:52 by lknife |
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converge problem all again.
Started by rose |
6 Replies
22911 Views |
March 21, 2017, 11:40 by Petr Khomyakov |
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Optimization
Started by Inaoton |
4 Replies
29704 Views |
March 21, 2017, 10:06 by Inaoton |
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4 Replies
21424 Views |
March 20, 2017, 23:30 by zmisha |
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Interatomic potantials
Started by berna |
1 Replies
23029 Views |
March 20, 2017, 10:01 by Daniele Stradi |
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charged molecule between electrodes
Started by SandraRG |
1 Replies
18111 Views |
March 18, 2017, 06:36 by zh |
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self consistent with SOC
Started by xiaoteng |
11 Replies
33650 Views |
March 16, 2017, 13:32 by xiaoteng |
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Bloch state velocity in silicene = 0 !!!
Started by narin |
10 Replies
42269 Views |
March 14, 2017, 21:47 by narin |
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Sabalcore Problem
Started by berna |
5 Replies
21900 Views |
March 14, 2017, 20:24 by berna |
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Pbnm space group
Started by j.mcghee |
1 Replies
15799 Views |
March 13, 2017, 19:31 by Anders Blom |
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2 Replies
12223 Views |
March 13, 2017, 12:30 by wot19920302 |
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Bloch-state velocity
Started by narin |
1 Replies
10523 Views |
March 12, 2017, 20:47 by Petr Khomyakov |
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post processing analysis
Started by surajmec |
4 Replies
11298 Views |
March 12, 2017, 18:13 by Petr Khomyakov |
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supercell formation
Started by sprinkle |
1 Replies
11254 Views |
March 10, 2017, 08:56 by Anders Blom |
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how to set up LDA+U+SOC calculation?
Started by arlonne |
2 Replies
16490 Views |
March 9, 2017, 11:52 by Petr Khomyakov |
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VibrationalMode of molecule
Started by kaypu |
1 Replies
26531 Views |
March 9, 2017, 07:47 by Jess Wellendorff |
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