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301
Orbital Contribution to MRSCF State by PhilipW
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4 | 1,811 | 2023-12-14 16:35:12 by PhilipW |
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302
HOMO and LUMO for open-shell systems by saeed_E
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4 | 2,397 | 2023-12-14 14:10:36 by saeed_E |
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303
About sobEDA analysis by saeed_E
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2 | 1,550 | 2023-12-13 08:13:28 by saeed_E |
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304
ETS-NOCV: How to interpret energy terms? by GeorgVienna
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4 | 2,072 | 2023-12-13 06:15:52 by GeorgVienna |
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305
sobEDA with Orca by michaelp
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4 | 2,684 | 2023-12-11 14:18:29 by axeljr7 |
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306
ICSS plots by jok42bm
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15 | 8,247 | 2023-12-08 09:58:45 by sobereva |
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307 |
2 | 1,687 | 2023-12-08 08:27:43 by mverissi |
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308 |
5 | 2,447 | 2023-11-28 17:08:27 by sobereva |
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309 |
3 | 1,457 | 2023-11-24 12:36:33 by limmi |
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310 |
4 | 1,722 | 2023-11-23 20:36:47 by sobereva |
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311 |
5 | 1,943 | 2023-11-23 00:26:09 by shaun |
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312 |
2 | 1,340 | 2023-11-22 09:29:10 by Egery |
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313 |
9 | 10,348 | 2023-11-17 09:18:32 by lheald |
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314 |
7 | 3,841 | 2023-11-09 07:41:38 by sobereva |
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315
help by mest2309
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14 | 20,920 | 2023-11-06 05:23:54 by krjt |
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316 |
0 | 722 | 2023-11-06 04:16:17 by Jwk |
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317 |
3 | 2,634 | 2023-11-03 13:27:33 by jxzou |
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318 |
2 | 1,407 | 2023-10-31 18:58:10 by PhilipW |
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319
spin density visualization by asenruhup@hotmail.com
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5 | 4,437 | 2023-10-29 07:04:55 by sobereva |
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320
Evaluation of EDA-NOCV data by kbreitwieser
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3 | 2,618 | 2023-10-28 02:11:50 by sobereva |
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321
Integrating by amichalchuk
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1 | 1,217 | 2023-10-25 01:34:27 by sobereva |
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322 |
1 | 1,123 | 2023-10-21 18:05:49 by sobereva |
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323
Spin density difference by Unnati jethawa
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1 | 1,123 | 2023-10-21 17:59:15 by sobereva |
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324
PLOTS : HELP by dampage
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1 | 894 | 2023-10-21 17:53:42 by sobereva |
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325 |
1 | 1,996 | 2023-10-21 17:49:59 by sobereva |
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326 |
2 | 1,375 | 2023-10-08 09:30:01 by dmpz |
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327
Calculating the volume of a molecule by e119340
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1 | 1,409 | 2023-10-06 23:45:17 by sobereva |
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328 |
1 | 1,233 | 2023-10-04 22:42:58 by sobereva |
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329
GNUplot command prompt by Louischarlc0
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22 | 12,986 | 2023-09-30 22:05:21 by sobereva |
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330 |
2 | 1,281 | 2023-09-20 22:48:28 by sobereva |