From a9c59539279b5ded72252cc7c9fbdb9631d193b6 Mon Sep 17 00:00:00 2001 From: EnzoMonino Date: Tue, 19 Jan 2021 14:37:10 +0100 Subject: [PATCH] remove tddft qchem results --- output/H2/TDDFT/tddft_eighth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_fifth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_first_excitation | 71 ------------------------ output/H2/TDDFT/tddft_fourth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_ninth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_second_excitation | 71 ------------------------ output/H2/TDDFT/tddft_seventh_excitation | 71 ------------------------ output/H2/TDDFT/tddft_sixth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_tenth_excitation | 71 ------------------------ output/H2/TDDFT/tddft_third_excitation | 71 ------------------------ 10 files changed, 710 deletions(-) delete mode 100644 output/H2/TDDFT/tddft_eighth_excitation delete mode 100644 output/H2/TDDFT/tddft_fifth_excitation delete mode 100644 output/H2/TDDFT/tddft_first_excitation delete mode 100644 output/H2/TDDFT/tddft_fourth_excitation delete mode 100644 output/H2/TDDFT/tddft_ninth_excitation delete mode 100644 output/H2/TDDFT/tddft_second_excitation delete mode 100644 output/H2/TDDFT/tddft_seventh_excitation delete mode 100644 output/H2/TDDFT/tddft_sixth_excitation delete mode 100644 output/H2/TDDFT/tddft_tenth_excitation delete mode 100644 output/H2/TDDFT/tddft_third_excitation diff --git a/output/H2/TDDFT/tddft_eighth_excitation b/output/H2/TDDFT/tddft_eighth_excitation deleted file mode 100644 index 373384b..0000000 --- a/output/H2/TDDFT/tddft_eighth_excitation +++ /dev/null @@ -1,71 +0,0 @@ -21.9204 -21.4348 -20.9818 -20.5594 -20.1659 -19.7993 -19.4579 -19.1397 -18.8426 -18.5651 -18.3055 -18.0628 -17.8364 -17.5671 -17.1706 -16.8010 -16.4569 -16.1371 -15.8404 -15.5656 -15.3113 -15.2734 -14.8591 -14.6586 -14.4737 -14.3030 -14.1457 -14.0005 -13.8666 -13.7430 -13.6842 -13.6922 -13.7052 -13.7228 -13.7445 -13.7698 -13.7982 -13.8291 -13.8620 -13.8964 -13.9318 -13.9678 -14.0039 -14.0397 -14.0749 -14.1091 -14.1420 -14.1734 -14.2031 -14.2310 -14.2568 -14.2806 -14.3022 -14.3216 -14.3389 -14.3542 -14.3674 -14.3787 -14.3882 -14.3959 -14.4020 -14.4066 -14.4099 -14.4119 -14.4129 -14.4128 -14.4120 -14.4103 -14.4081 -16.1441 -16.1464 diff --git a/output/H2/TDDFT/tddft_fifth_excitation b/output/H2/TDDFT/tddft_fifth_excitation deleted file mode 100644 index 2b844cd..0000000 --- a/output/H2/TDDFT/tddft_fifth_excitation +++ /dev/null @@ -1,71 +0,0 @@ -19.1337 -18.6138 -18.1335 -17.6905 -17.2826 -16.9075 -16.5632 -16.2472 -15.9573 -15.6916 -15.4481 -15.2254 -15.0223 -14.7979 -14.4915 -14.2088 -13.9476 -13.7059 -13.4820 -13.2745 -13.1272 -13.8861 -12.9664 -12.8930 -12.8240 -12.7595 -12.6995 -12.6440 -12.5929 -12.5459 -12.5022 -12.4609 -12.4211 -12.3819 -12.3428 -12.3036 -12.2642 -12.2248 -12.1856 -12.1466 -12.1077 -12.0685 -12.0286 -11.9874 -11.9442 -11.8985 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--3.3976 --3.4287 --3.4585 --3.4869 --3.5141 -7.5419 -7.5794 diff --git a/output/H2/TDDFT/tddft_fourth_excitation b/output/H2/TDDFT/tddft_fourth_excitation deleted file mode 100644 index 52f29cc..0000000 --- a/output/H2/TDDFT/tddft_fourth_excitation +++ /dev/null @@ -1,71 +0,0 @@ -16.8959 -16.5328 -16.1987 -15.8933 -15.6142 -15.3581 -15.1217 -14.9024 -14.6986 -14.5093 -14.3337 -14.1710 -14.0202 -13.8800 -13.7497 -13.6281 -13.5146 -13.4083 -13.3086 -13.2151 -13.0819 -13.0042 -12.7371 -12.5828 -12.4392 -12.3056 -12.1811 -12.0651 -11.9569 -11.8559 -11.7615 -11.6734 -11.5909 -11.5139 -11.4418 -11.3745 -11.3116 -11.2529 -11.1982 -11.1473 -11.0999 -11.0560 -11.0151 -10.9770 -10.9415 -10.9082 -10.8768 -10.8472 -10.8192 -10.7926 -10.7673 -10.7435 -10.7210 -10.6998 -10.6799 -10.6615 -10.6445 -10.6290 -10.6150 -10.6026 -10.5916 -10.5820 -10.5738 -10.5666 -10.5603 -10.5548 -10.5498 -10.5451 -10.5404 -12.3220 -12.3143 diff --git a/output/H2/TDDFT/tddft_ninth_excitation b/output/H2/TDDFT/tddft_ninth_excitation deleted file mode 100644 index dba1be0..0000000 --- a/output/H2/TDDFT/tddft_ninth_excitation +++ /dev/null @@ -1,71 +0,0 @@ -22.2536 -21.4939 -20.9818 -20.5594 -20.1659 -19.7993 -19.4579 -19.1397 -18.8426 -18.5651 -18.3055 -18.0628 -17.8364 -17.6256 -17.4301 -17.2493 -17.0825 -16.9289 -16.7877 -16.6579 -16.5391 -16.5326 -16.3320 -16.2430 -16.1631 -16.0918 -15.8382 -15.5019 -15.1813 -14.8781 -14.5935 -14.3279 -14.0815 -13.8535 -13.7445 -13.7698 -13.7982 -13.8291 -13.8620 -13.8964 -13.9318 -13.9678 -14.0039 -14.0397 -14.0749 -14.1091 -14.1420 -14.1734 -14.2031 -14.2310 -14.2568 -14.2806 -14.3022 -14.3216 -14.3389 -14.3542 -14.3674 -14.3787 -14.3882 -14.3959 -14.4020 -14.4066 -14.4099 -14.4119 -14.4129 -14.4128 -14.4120 -14.4103 -14.4081 -16.2626 -16.2605 diff --git a/output/H2/TDDFT/tddft_second_excitation b/output/H2/TDDFT/tddft_second_excitation deleted file mode 100644 index 3c1a888..0000000 --- a/output/H2/TDDFT/tddft_second_excitation +++ /dev/null @@ -1,71 +0,0 @@ -14.8853 -14.5173 -14.1795 -13.7844 -13.3389 -12.9158 -12.5137 -12.1310 -11.7664 -11.4190 -11.0881 -10.7732 -10.4737 -10.1891 -9.9190 -9.6631 -9.4210 -9.1925 -8.9771 -8.7747 -8.5848 -8.1604 -8.2413 -8.0868 -7.9431 -7.8099 -7.6865 -7.5726 -7.4677 -7.3712 -7.2827 -7.2017 -7.1278 -7.0606 -6.9996 -6.9444 -6.8947 -6.8500 -6.8100 -6.7743 -6.7427 -6.7148 -6.6903 -6.6689 -6.6503 -6.6343 -6.6207 -6.6092 -6.5997 -6.5920 -6.5859 -6.5813 -6.5780 -6.5759 -6.5748 -6.5747 -6.5755 -6.5770 -6.5793 -6.5822 -6.5856 -6.5896 -6.5940 -6.5988 -6.6039 -6.6092 -6.6148 -6.6205 -6.6262 -7.5645 -7.5999 diff --git a/output/H2/TDDFT/tddft_seventh_excitation b/output/H2/TDDFT/tddft_seventh_excitation deleted file mode 100644 index 26c462b..0000000 --- a/output/H2/TDDFT/tddft_seventh_excitation +++ /dev/null @@ -1,71 +0,0 @@ -21.9204 -21.4348 -20.7149 -19.9385 -19.2008 -18.5203 -17.8969 -17.3263 -16.8043 -16.3273 -15.8919 -15.4945 -15.1311 -14.8378 -14.6710 -14.5209 -14.3867 -14.2673 -14.1616 -14.0686 -13.9876 -14.4484 -13.8580 -13.8082 -13.7676 -13.7355 -13.7114 -13.6948 -13.6850 -13.6816 -13.6842 -13.6922 -13.7052 -13.7228 -13.6432 -13.4497 -13.2727 -13.1122 -12.9874 -12.9342 -12.8858 -12.8420 -12.8023 -12.7664 -12.7339 -12.7044 -12.6775 -12.6531 -12.6309 -12.6439 -12.7148 -12.7963 -12.8861 -12.9821 -13.0822 -13.1844 -13.2871 -13.3885 -13.4872 -13.5819 -13.6714 -13.7548 -13.8314 -13.9009 -13.9632 -14.0186 -14.0676 -14.1105 -14.1480 -16.1441 -16.1464 diff --git a/output/H2/TDDFT/tddft_sixth_excitation b/output/H2/TDDFT/tddft_sixth_excitation deleted file mode 100644 index c5e1344..0000000 --- a/output/H2/TDDFT/tddft_sixth_excitation +++ /dev/null @@ -1,71 +0,0 @@ -19.1337 -18.6138 -18.1335 -17.6905 -17.2826 -16.9075 -16.5632 -16.2472 -15.9573 -15.6916 -15.4481 -15.2254 -15.0223 -14.8378 -14.6710 -14.5209 -14.3867 -14.2673 -14.1616 -14.0686 -13.9876 -14.4484 -13.8580 -13.8082 -13.7676 -13.7355 -13.7114 -13.6948 -13.6850 -13.6816 -13.6290 -13.5238 -13.4268 -13.3373 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-8.9759 -12.3014 -12.2946