Index of /docs/nwchem/nwchem-support/2009/04

[ICO]NameLast modifiedSizeDescription
[ ]Parent Directory   -
[ ]0001._NWCHEM_A_quest..>03-Apr-2009 06:14 2.0K
[ ]0002._NWCHEM_BSSE_RI..>05-Apr-2009 14:07 3.1K
[ ]0003.Fwd:_NWCHEM_BSS..>05-Apr-2009 15:35 4.2K
[ ]0004._NWCHEM_can_t_c..>05-Apr-2009 17:58 6.2K
[ ]0005._NWCHEM_NWChem_..>07-Apr-2009 08:04 2.6K
[ ]0006.Re:_NWCHEM_NWCh..>07-Apr-2009 08:44 4.3K
[ ]0007._NWCHEM_DISP_op..>07-Apr-2009 08:44 12K
[ ]0008.Re:_NWCHEM_DISP..>07-Apr-2009 09:02 2.6K
[ ]0009.Re:_NWCHEM_NWCh..>07-Apr-2009 09:15 2.7K
[ ]0010.Re:_NWCHEM_DISP..>07-Apr-2009 09:15 2.6K
[ ]0011._NWCHEM_restart..>07-Apr-2009 10:06 6.1K
[ ]0012._NWCHEM_strange..>07-Apr-2009 12:23 3.8K
[ ]0013._NWCHEM_Re:_can..>07-Apr-2009 12:24 7.2K
[ ]0014.RE:_NWCHEM_stra..>07-Apr-2009 12:28 4.6K
[ ]0015.Re:_NWCHEM_stra..>07-Apr-2009 12:37 6.4K
[ ]0016.Re:_NWCHEM_stra..>07-Apr-2009 12:44 5.9K
[ ]0017.Re:_NWCHEM_Re:_..>07-Apr-2009 12:54 6.9K
[ ]0018.Re:_NWCHEM_stra..>07-Apr-2009 13:06 5.3K
[ ]0019.Re:_NWCHEM_stra..>07-Apr-2009 13:39 6.1K
[ ]0020.Re:_NWCHEM_stra..>07-Apr-2009 13:41 6.9K
[ ]0021.Re:_NWCHEM_Re:_..>07-Apr-2009 14:11 9.1K
[ ]0022.Re:_NWCHEM_Re:_..>07-Apr-2009 14:31 8.5K
[ ]0023._NWCHEM_Questio..>08-Apr-2009 04:59 1.8K
[ ]0024.Re:_NWCHEM_Ques..>08-Apr-2009 05:33 4.6K
[ ]0025.Re:_NWCHEM_stra..>08-Apr-2009 09:23 7.6K
[ ]0026.Re:_NWCHEM_Ques..>08-Apr-2009 10:07 3.2K
[ ]0027._NWCHEM_CCSD_hy..>08-Apr-2009 12:28 3.7K
[ ]0028._NWCHEM_negativ..>08-Apr-2009 15:59 2.9K
[ ]0029._NWCHEM_ECP_que..>09-Apr-2009 09:07 6.1K
[ ]0030.RE:_NWCHEM_ECP_..>09-Apr-2009 09:10 6.5K
[ ]0031._NWCHEM_RE:_neg..>09-Apr-2009 10:44 5.3K
[ ]0032._NWCHEM_steepes..>09-Apr-2009 10:49 22K
[ ]0033._NWCHEM_aimd_ex..>09-Apr-2009 10:49 22K
[ ]0034._NWCHEM_FW:_sim..>09-Apr-2009 11:51 14K
[ ]0035.RE:_NWCHEM_rest..>09-Apr-2009 12:37 3.0K
[ ]0036._NWCHEM_frequen..>09-Apr-2009 12:46 3.9K
[ ]0037.RE:_NWCHEM_freq..>09-Apr-2009 13:27 7.4K
[ ]0038.RE:_NWCHEM_freq..>09-Apr-2009 14:56 9.1K
[ ]0039.RE:_NWCHEM_freq..>09-Apr-2009 17:30 11K
[ ]0040._NWCHEM_Analyti..>10-Apr-2009 11:46 2.2K
[ ]0041._NWCHEM_AIMD_nwpw 10-Apr-2009 20:30 2.4K
[ ]0042.Re:_NWCHEM_RE:_..>11-Apr-2009 09:50 2.4K
[ ]0043._NWCHEM_Cray_XT..>11-Apr-2009 11:30 5.9K
[ ]0044.Re:_NWCHEM_Cray..>11-Apr-2009 11:51 7.9K
[ ]0045.Re:_NWCHEM_RE:_..>13-Apr-2009 18:14 1.8K
[ ]0046._NWCHEM_unit_of..>14-Apr-2009 01:00 1.9K
[ ]0047.Re:_NWCHEM_unit..>14-Apr-2009 05:42 2.8K
[ ]0048._NWCHEM_CCSD_qu..>14-Apr-2009 07:43 4.6K
[ ]0049.Re:_NWCHEM_CCSD..>14-Apr-2009 08:54 4.9K
[ ]0050._NWCHEM_Fractio..>15-Apr-2009 08:30 1.8K
[ ]0051._NWCHEM_problem..>15-Apr-2009 15:15 1.7K
[ ]0052.Re:_NWCHEM_prob..>15-Apr-2009 15:36 1.9K
[ ]0053._NWCHEM_Analyti..>15-Apr-2009 15:48 1.8K
[ ]0054.Re:_NWCHEM_prob..>15-Apr-2009 18:08 3.1K
[ ]0055._NWCHEM_DISP_op..>15-Apr-2009 23:56 3.0K
[ ]0056._NWCHEM_problem..>16-Apr-2009 02:03 1.8K
[ ]0057.RE:_NWCHEM_DISP..>16-Apr-2009 07:26 3.9K
[ ]0058.Re:_NWCHEM_prob..>16-Apr-2009 09:35 2.0K
[ ]0059._NWCHEM_Compila..>16-Apr-2009 12:32 5.8K
[ ]0060.RE:_NWCHEM_DISP..>16-Apr-2009 12:44 4.9K
[ ]0061._NWCHEM_basis_s..>16-Apr-2009 14:08 2.2K
[ ]0062.RE:_NWCHEM_basi..>16-Apr-2009 14:36 2.9K
[ ]0063._NWCHEM_Open_Sh..>16-Apr-2009 14:53 4.9K
[ ]0064.RE:_NWCHEM_Comp..>16-Apr-2009 14:58 5.4K
[ ]0065._NWCHEM_RE:_AIM..>16-Apr-2009 15:02 1.9K
[ ]0066.RE:_NWCHEM_Open..>16-Apr-2009 15:04 7.4K
[ ]0067.RE:_NWCHEM_RE:_..>16-Apr-2009 15:04 1.9K
[ ]0068.RE:_NWCHEM_stee..>16-Apr-2009 15:06 4.9K
[ ]0069._NWCHEM_QM_MM_I..>16-Apr-2009 15:12 20K
[ ]0070.Re:_NWCHEM_Open..>16-Apr-2009 15:13 3.7K
[ ]0071.RE:_NWCHEM_Frac..>16-Apr-2009 15:44 28K
[ ]0072.RE:_NWCHEM_Open..>16-Apr-2009 16:15 3.5K
[ ]0073._NWCHEM_DFT_U 16-Apr-2009 17:26 2.2K
[ ]0074.Re:_NWCHEM_QM_M..>17-Apr-2009 00:47 3.5K
[ ]0075._NWCHEM_Calcula..>17-Apr-2009 02:45 1.7K
[ ]0076.Re:_NWCHEM_Calc..>17-Apr-2009 06:38 3.8K
[ ]0077.Re:_NWCHEM_QM_M..>17-Apr-2009 08:27 3.6K
[ ]0078.RE:_NWCHEM_DFT_U 17-Apr-2009 09:50 4.7K
[ ]0079.Re:_NWCHEM_QM_M..>17-Apr-2009 10:02 4.1K
[ ]0080.RE:_NWCHEM_QM_M..>17-Apr-2009 10:30 4.3K
[ ]0081.RE:_NWCHEM_DFT_U 18-Apr-2009 07:29 1.8K
[ ]0082.RE:_NWCHEM_DFT_U 18-Apr-2009 11:40 4.1K
[ ]0083.RE:_NWCHEM_DFT_U 18-Apr-2009 12:17 5.2K
[ ]0084._NWCHEM_compila..>18-Apr-2009 12:18 2.0K
[ ]0085.Re:_NWCHEM_comp..>18-Apr-2009 13:06 6.5K
[ ]0086.RE:_NWCHEM_DFT_U 18-Apr-2009 13:12 4.3K
[ ]0087.Re:_NWCHEM_comp..>18-Apr-2009 14:09 10K
[ ]0088.Re:_NWCHEM_comp..>18-Apr-2009 15:53 5.5K
[ ]0089.RE:_NWCHEM_DFT_U 18-Apr-2009 19:07 11K
[ ]0090.RE:_NWCHEM_comp..>19-Apr-2009 15:30 2.6K
[ ]0091.RE:_NWCHEM_comp..>19-Apr-2009 15:30 11K
[ ]0092.RE:_NWCHEM_DFT_U 19-Apr-2009 15:48 17K
[ ]0093.Re:_NWCHEM_comp..>19-Apr-2009 17:47 12K
[ ]0094.RE:_NWCHEM_comp..>19-Apr-2009 19:02 14K
[ ]0095.Re:_NWCHEM_comp..>19-Apr-2009 19:22 3.1K
[ ]0096._NWCHEM_Error_a..>20-Apr-2009 07:22 5.7K
[ ]0097._NWCHEM_Insuffi..>21-Apr-2009 14:44 1.6K
[ ]0098.Re:_NWCHEM_Insu..>21-Apr-2009 14:54 2.8K
[ ]0099.Re:_NWCHEM_Insu..>21-Apr-2009 15:47 2.7K
[ ]0100.RE:_NWCHEM_Insu..>21-Apr-2009 16:02 3.2K
[ ]0101.RE:_NWCHEM_Insu..>21-Apr-2009 16:07 14K
[ ]0102.RE:_NWCHEM_Insu..>21-Apr-2009 16:18 4.2K
[ ]0103.RE:_NWCHEM_Insu..>21-Apr-2009 16:23 13K
[ ]0104.Re:_NWCHEM_Insu..>21-Apr-2009 16:29 5.9K
[ ]0105.RE:_NWCHEM_Insu..>21-Apr-2009 17:02 5.7K
[ ]0106._NWCHEM_TDDFT_w..>21-Apr-2009 17:51 2.3K
[ ]0107.RE:_NWCHEM_TDDF..>21-Apr-2009 17:53 4.9K
[ ]0108.Re:_NWCHEM_Insu..>22-Apr-2009 07:17 3.2K
[ ]0109.Re:_NWCHEM_Insu..>22-Apr-2009 07:42 6.0K
[ ]0110.Re:_NWCHEM_TDDF..>22-Apr-2009 09:17 1.7K
[ ]0111.RE:_NWCHEM_TDDF..>22-Apr-2009 09:28 2.6K
[ ]0112.RE:_NWCHEM_TDDF..>22-Apr-2009 10:01 8.4K
[ ]0113.Re:_NWCHEM_Insu..>23-Apr-2009 08:12 5.8K
[ ]0114.RE:_NWCHEM_Insu..>23-Apr-2009 08:35 6.4K
[ ]0115._NWCHEM_T1_diag..>23-Apr-2009 08:58 1.4K
[ ]0116.RE:_NWCHEM_T1_d..>23-Apr-2009 09:11 1.9K
[ ]0117.Re:_NWCHEM_T1_d..>23-Apr-2009 09:25 3.6K
[ ]0118._NWCHEM_CCSD_T_..>24-Apr-2009 09:37 1.9K
[ ]0119.Re:_NWCHEM_CCSD..>24-Apr-2009 09:43 3.8K
[ ]0120.RE:_NWCHEM_CCSD..>24-Apr-2009 09:53 2.5K
[ ]0121.RE:_NWCHEM_CCSD..>24-Apr-2009 10:12 3.8K
[ ]0122.Re:_NWCHEM_CCSD..>24-Apr-2009 10:19 5.1K
[ ]0123.Re:_NWCHEM_CCSD..>26-Apr-2009 20:49 3.4K
[ ]0124._NWCHEM_error_c..>27-Apr-2009 08:17 5.1K
[ ]0125.RE:_NWCHEM_erro..>27-Apr-2009 09:50 5.6K
[ ]0126._NWCHEM_how_to_..>27-Apr-2009 09:56 4.6K
[ ]0127.RE:_NWCHEM_how_..>27-Apr-2009 11:23 6.6K
[ ]0128._NWCHEM_FW:_abo..>27-Apr-2009 12:20 1.8K
[ ]0129.RE:_NWCHEM_FW:_..>27-Apr-2009 12:24 2.1K
[ ]0130.RE:_NWCHEM_how_..>27-Apr-2009 17:28 9.3K
[ ]0131.Re:_NWCHEM_how_..>27-Apr-2009 17:36 4.7K
[ ]0132.RE:_NWCHEM_CCSD..>27-Apr-2009 17:43 4.4K
[ ]0133.RE:_NWCHEM_how_..>28-Apr-2009 07:27 3.7K
[ ]0134._NWCHEM_QMMM_pr..>28-Apr-2009 15:44 15K
[ ]0135.Re:_NWCHEM_CCSD..>28-Apr-2009 15:46 2.9K
[ ]0136.Re:_NWCHEM_CCSD..>28-Apr-2009 16:03 5.8K
[ ]0137.Re:_NWCHEM_CCSD..>28-Apr-2009 16:14 5.1K
[ ]0138._NWCHEM_tddft_d..>28-Apr-2009 16:54 1.5K
[ ]0139.RE:_NWCHEM_tddf..>28-Apr-2009 17:57 2.1K
[ ]0140.Re:_NWCHEM_tddf..>28-Apr-2009 19:12 3.4K
[ ]0141.RE:_NWCHEM_tddf..>28-Apr-2009 19:19 2.2K
[ ]0142._NWCHEM_NWChem_..>29-Apr-2009 09:02 6.1K
[ ]0143.Re:_NWCHEM_NWCh..>29-Apr-2009 09:16 8.0K
[ ]0144.Re:_NWCHEM_NWCh..>29-Apr-2009 09:29 8.3K
[ ]0145.Re:_NWCHEM_NWCh..>29-Apr-2009 09:36 8.4K
[ ]0146.Re:_NWCHEM_NWCh..>29-Apr-2009 11:17 10K
[ ]0147.Re:_NWCHEM_NWCh..>29-Apr-2009 12:00 10K
[ ]0148.Re:_NWCHEM_NWCh..>29-Apr-2009 12:26 12K
[ ]0149.Re:_NWCHEM_NWCh..>29-Apr-2009 12:47 12K
[ ]0150.RE:_NWCHEM_Insu..>29-Apr-2009 14:11 7.0K
[ ]0151.Re:_NWCHEM_NWCh..>29-Apr-2009 15:35 3.1K
[ ]0152.RE:_NWCHEM_QMMM..>30-Apr-2009 09:55 7.0K
[ ]0153._NWCHEM_ONIOM-P..>30-Apr-2009 14:09 11K
[ ]0154.Re:_NWCHEM_ONIO..>30-Apr-2009 14:55 5.4K