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nonadiabatic coupling vector
Started by jzstdo |
4 Replies
33372 Views |
February 15, 2017, 03:34:43 PMby christof.haettig |
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2 Replies
33461 Views |
August 11, 2021, 11:01:09 AM by fedor |
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1 Replies
33503 Views |
January 18, 2019, 05:26:31 PM by uwe |
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4 Replies
34064 Views |
April 15, 2008, 06:48:05 PM by sca |
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3 Replies
34071 Views |
September 25, 2008, 10:32:02 AM by uwe |
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How to comment in define input file
Started by xiang |
2 Replies
34091 Views |
March 31, 2019, 07:37:20 PM by uwe |
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4 Replies
34222 Views |
August 23, 2018, 12:28:46 PM by evgeniy |
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electric field unit
Started by patrikrydberg |
1 Replies
35459 Views |
April 15, 2008, 06:16:48 PM by christof.haettig |
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DFT+D calculations
Started by bademoor |
3 Replies
36486 Views |
April 18, 2008, 12:12:17 PM by bademoor |
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Ired crashes define
Started by Michael_Patzschke |
2 Replies
37170 Views |
October 12, 2023, 06:57:32 AM by Michael_Patzschke |
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2 Replies
37603 Views |
September 15, 2021, 04:42:41 PM by uwe |
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optimisation from hessian
Started by monika |
1 Replies
37843 Views |
January 23, 2007, 12:36:54 PM by turbomaster |
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Re: eht for ion Rb
Started by yuniawan |
8 Replies
38199 Views |
November 02, 2015, 02:24:45 PM by yuniawan |
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User-defined functionals
Started by lien.bentein |
5 Replies
38510 Views |
August 04, 2009, 10:23:53 AM by uwe |
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heavy atoms without ecp
Started by fru14909 |
4 Replies
39519 Views |
March 02, 2021, 12:31:33 PM by Scoops |
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Define dies with 'Too many atoms'
Started by Arrepiadd |
4 Replies
39648 Views |
April 25, 2008, 10:55:34 AM by Arrepiadd |
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5 Replies
39773 Views |
September 10, 2018, 09:45:45 PM by uwe |
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EHT dimension problem
Started by Raffaele Credendino |
7 Replies
42790 Views |
November 15, 2017, 05:23:04 AM by juhidutta |
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Automatimg Define
Started by ym21d@fsu.edu |
7 Replies
48388 Views |
June 25, 2025, 08:45:21 PM by ym21d@fsu.edu |
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8 Replies
53931 Views |
March 15, 2022, 09:43:35 AM by prasanta13 |
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