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- Calculation of Dipole Transistion Elements
by dscullion12 » Mon Sep 26, 2016 5:21 pm - 0 Replies
- 412 Views
- Last post by dscullion12
Mon Sep 26, 2016 5:21 pm
- Calculation of Dipole Transistion Elements
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- ORBITALMAG facility: is this production-ready?
by jzwanzig » Thu Sep 15, 2016 5:15 pm - 0 Replies
- 278 Views
- Last post by jzwanzig
Thu Sep 15, 2016 5:15 pm
- ORBITALMAG facility: is this production-ready?
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- Compatibility between IBRION=6 and LEPSILON
by jzwanzig » Thu Sep 01, 2016 7:50 pm - 2 Replies
- 324 Views
- Last post by jzwanzig
Thu Sep 15, 2016 5:09 pm
- Compatibility between IBRION=6 and LEPSILON
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- About Patches
by zhangwb@csust.edu.cn » Tue Aug 30, 2016 10:42 am - 3 Replies
- 337 Views
- Last post by admin
Wed Aug 31, 2016 8:07 am
- About Patches
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- bug symmetrization charge density?
by tberlijn » Mon Aug 29, 2016 9:00 pm - 0 Replies
- 174 Views
- Last post by tberlijn
Mon Aug 29, 2016 9:00 pm
- bug symmetrization charge density?
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- Segmentation fault with empty POSCAR
by mwistey » Wed Aug 10, 2016 10:56 pm - 1 Replies
- 241 Views
- Last post by alex
Thu Aug 25, 2016 9:57 am
- Segmentation fault with empty POSCAR
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- Performance loss due to context switching
by jun » Wed Aug 10, 2016 3:50 am - 0 Replies
- 183 Views
- Last post by jun
Wed Aug 10, 2016 3:50 am
- Performance loss due to context switching
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- VASP hangs after NELM or LABORT
by mwistey » Tue Aug 09, 2016 6:51 am - 0 Replies
- 234 Views
- Last post by mwistey
Tue Aug 09, 2016 6:51 am
- VASP hangs after NELM or LABORT
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- temperature dependent bulk modulus from QHA-fit
by freshwind » Fri Aug 05, 2016 8:29 am - 0 Replies
- 209 Views
- Last post by freshwind
Fri Aug 05, 2016 8:29 am
- temperature dependent bulk modulus from QHA-fit
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- Inconsistent Ground Energy
by dengban » Fri Jul 29, 2016 6:31 pm - 0 Replies
- 158 Views
- Last post by dengban
Fri Jul 29, 2016 6:31 pm
- Inconsistent Ground Energy
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- Nonlocal vdW functionals with non-collinear (LSORB)
by Infant » Thu Jul 28, 2016 10:50 am - 2 Replies
- 273 Views
- Last post by Infant
Fri Jul 29, 2016 1:36 pm
- Nonlocal vdW functionals with non-collinear (LSORB)
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- average potential at core in vasprun
by Emmanuel » Wed Jul 13, 2016 3:27 pm - 2 Replies
- 286 Views
- Last post by Emmanuel
Wed Jul 20, 2016 1:07 pm
- average potential at core in vasprun
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- Can't activate Van Der Waals calculation in 5.4.1
by chelman » Thu Jun 30, 2016 9:51 pm - 1 Replies
- 370 Views
- Last post by admin
Wed Jul 13, 2016 10:24 am
- Can't activate Van Der Waals calculation in 5.4.1
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- deepest layers comes on top of surface after vacuum space
by venkatramana » Fri Jun 24, 2016 8:42 am - 3 Replies
- 264 Views
- Last post by tfrankcombe
Wed Jul 13, 2016 4:25 am
- deepest layers comes on top of surface after vacuum space
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- VASP_POSCAR_File
by vj181 » Sun Jul 10, 2016 4:15 am - 1 Replies
- 176 Views
- Last post by admin
Mon Jul 11, 2016 10:22 am
- VASP_POSCAR_File
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- Unphysical value of DOS : EMIN, EMAX, NEDOS
by deepashri » Mon Jun 27, 2016 12:04 pm - 1 Replies
- 608 Views
- Last post by jnokelai
Mon Jun 27, 2016 3:05 pm
- Unphysical value of DOS : EMIN, EMAX, NEDOS
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- During ionic relaxation, energy jumps dramatically
by sjtuzhanglei » Sat Jun 11, 2016 10:44 pm - 2 Replies
- 379 Views
- Last post by sjtuzhanglei
Mon Jun 13, 2016 4:33 pm
- During ionic relaxation, energy jumps dramatically
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- BUG in DOS calculation and vasprun.xml wrinting
by pmignon » Thu Jun 09, 2016 4:47 pm - 1 Replies
- 208 Views
- Last post by admin
Fri Jun 10, 2016 9:30 am
- BUG in DOS calculation and vasprun.xml wrinting
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- Pseudopotential of Nd and Sm
by aina2412 » Tue May 31, 2016 11:46 am - 3 Replies
- 411 Views
- Last post by admin
Thu Jun 02, 2016 1:42 pm
- Pseudopotential of Nd and Sm
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- Correct use of POTCAR files
by mikhail » Mon May 30, 2016 2:58 pm - 2 Replies
- 1255 Views
- Last post by mikhail
Wed Jun 01, 2016 12:02 pm
- Correct use of POTCAR files
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