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151
EDA analysis for host:guest system by Sailendra Pradhan
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1 | 1,116 | 2025-04-28 18:01:26 by sobereva |
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152
sobEDA by miguel-munoz
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1 | 1,603 | 2025-04-26 00:26:26 by sobereva |
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153
from fchk produce wfx with virtual orbitals by choconostle123
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1 | 1,179 | 2025-04-18 00:16:52 by sobereva |
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154 |
1 | 1,476 | 2025-04-15 23:00:31 by sobereva |
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155 |
0 | 993 | 2025-04-13 01:54:53 by sobereva |
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156 |
1 | 1,470 | 2025-04-10 00:51:17 by sobereva |
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157
Charge Transfer for S1->T1 conversion by andrzejek
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5 | 2,754 | 2025-04-09 13:00:38 by sobereva |
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158
VASP Multiwfn support by Abdulrahman Allangawi
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2 | 1,457 | 2025-04-02 19:12:29 by Abdulrahman Allangawi |
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159 |
9 | 4,022 | 2025-03-31 10:54:36 by monthem |
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160
GAMESS TDA-DFT Support by zander_z
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4 | 2,130 | 2025-03-27 14:57:49 by zander_z |
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161 |
1 | 1,220 | 2025-03-26 11:57:07 by sobereva |
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162
EDA calculation is not going to complete by Sumitkadam
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6 | 2,912 | 2025-03-26 04:13:19 by Sumitkadam |
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163 |
2 | 1,469 | 2025-03-23 08:58:11 by pujarini |
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164 |
3 | 1,842 | 2025-03-22 13:48:28 by joutaque |
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165
Problem in EDA analysis by Sumitkadam
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7 | 3,035 | 2025-03-21 04:26:30 by Sumitkadam |
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166 |
16 | 8,269 | 2025-03-11 19:22:18 by saeed_E |
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167
Error molden file by marta
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1 | 1,289 | 2025-03-11 12:52:09 by sobereva |
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168
Assistance in Visualizing Specific Interactions in NCI Analysis by Lukhmanul Hakeem k
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2 | 2,013 | 2025-03-06 07:41:31 by Lukhmanul Hakeem k |
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169
CVB Index by rodrigocormanich
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1 | 1,331 | 2025-03-05 20:12:40 by sobereva |
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170 |
6 | 2,727 | 2025-03-05 11:42:37 by saeed_E |
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171
Hole-electron/hole-only distribution by Abdulrahman Allangawi
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2 | 1,543 | 2025-03-02 14:14:12 by Abdulrahman Allangawi |
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172
Reading .gbw file from QM/XTB calculation (ORCA) by electrogeek
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2 | 1,928 | 2025-02-26 09:32:13 by electrogeek |
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173
Lifetimes of excited states in TDDFT by Abdulrahman Allangawi
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3 | 1,875 | 2025-02-26 03:53:45 by sobereva |
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174
ELF-alpha and ELF-beta by rodrigocormanich
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4 | 2,170 | 2025-02-23 19:53:24 by rodrigocormanich |
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175 |
2 | 1,513 | 2025-02-18 07:58:09 by saeed_E |
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176
Chalcogen interaction not picked up with AIM by corey.taylor
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4 | 2,410 | 2025-02-17 08:21:20 by corey.taylor |
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177 |
2 | 1,474 | 2025-02-13 18:47:24 by Antuán |
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178 |
3 | 1,715 | 2025-02-11 09:24:36 by lsimon |
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179 |
1 | 1,191 | 2025-02-10 18:46:07 by sobereva |
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180 |
1 | 1,542 | 2025-02-08 20:28:25 by sobereva |