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4641 Views |
February 17, 2011, 08:05:28 AM by tosa |
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freeh module and contractions
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1 Replies
5702 Views |
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Frozen coordinates
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frozen coordinates
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8 Replies
20080 Views |
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5 Replies
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Global Minimum
Started by kiranb |
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3693 Views |
February 23, 2018, 11:16:51 PM by kiranb |
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0 Replies
2815 Views |
January 26, 2023, 04:06:37 PM by ym21d@fsu.edu |
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Heavy elements and relativistic effects
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How to calculate dG
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February 18, 2009, 02:43:18 PM by FKoehler |
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how to run JOBBSSE
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Huge Binaries
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internal reaction coordinate
Started by jbaltrus |
0 Replies
4820 Views |
June 27, 2010, 01:01:52 AM by jbaltrus |
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IRC calculations
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1 Replies
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1 Replies
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Jobbsse Problem
Started by idet2 |
0 Replies
4683 Views |
June 26, 2009, 08:54:44 AM by idet2 |
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Keywords for density matrix, fock matrix
Started by Amin |
2 Replies
2994 Views |
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0 Replies
5611 Views |
July 13, 2020, 06:51:56 PM by chris.hol |
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Maximum number of atoms
Started by mike |
2 Replies
7974 Views |
March 09, 2018, 11:07:42 AM by uwe |
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