From 07f84f9e0800cd69182ce714140a8a4fc694b810 Mon Sep 17 00:00:00 2001 From: Pierre-Francois Loos Date: Wed, 22 Jan 2020 21:54:44 +0100 Subject: [PATCH] data --- BSE-PES.tex | 24 ++++++++++++------------ Data/BF_GS_VDZ.pdf | Bin 0 -> 49439 bytes Data/BF_GS_VDZ_FC.pdf | Bin 0 -> 49837 bytes Data/BF_GS_VTZ.pdf | Bin 0 -> 49716 bytes Data/BF_GS_VTZ_FC.pdf | Bin 0 -> 50085 bytes Data/CO_GS_VDZ.pdf | Bin 0 -> 47283 bytes Data/CO_GS_VDZ_FC.pdf | Bin 0 -> 47419 bytes Data/CO_GS_VTZ.pdf | Bin 0 -> 47969 bytes Data/CO_GS_VTZ_FC.pdf | Bin 0 -> 48503 bytes Data/F2_GS_VDZ.pdf | Bin 0 -> 48596 bytes Data/F2_GS_VDZ_FC.pdf | Bin 0 -> 49589 bytes Data/F2_GS_VTZ.pdf | Bin 0 -> 49353 bytes Data/H2_GS_VDZ.pdf | Bin 0 -> 49608 bytes Data/H2_GS_VQZ.pdf | Bin 0 -> 48837 bytes Data/H2_GS_VTZ.pdf | Bin 0 -> 48786 bytes Data/HCl_GS_VDZ.pdf | Bin 0 -> 48575 bytes Data/HCl_GS_VDZ_FC.pdf | Bin 0 -> 49633 bytes Data/HCl_GS_VTZ.pdf | Bin 0 -> 48996 bytes Data/HCl_GS_VTZ_FC.pdf | Bin 0 -> 49740 bytes Data/LiF_GS_VDZ.pdf | Bin 0 -> 48932 bytes Data/LiF_GS_VDZ_FC.pdf | Bin 0 -> 49787 bytes Data/LiF_GS_VTZ.pdf | Bin 0 -> 49463 bytes Data/LiF_GS_VTZ_FC.pdf | Bin 0 -> 49457 bytes Data/LiH_GS_VDZ.pdf | Bin 0 -> 49061 bytes Data/LiH_GS_VDZ_FC.pdf | Bin 0 -> 49724 bytes Data/LiH_GS_VTZ.pdf | Bin 0 -> 48952 bytes Data/LiH_GS_VTZ_FC.pdf | Bin 0 -> 49900 bytes Data/N2_GS_VDZ.pdf | Bin 0 -> 46003 bytes Data/N2_GS_VDZ_FC.pdf | Bin 0 -> 46458 bytes Data/N2_GS_VTZ.pdf | Bin 0 -> 47854 bytes Data/N2_GS_VTZ_FC.pdf | Bin 0 -> 49548 bytes Data/scan_BF_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_BF_VDZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VDZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VDZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_BF_VDZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VDZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VDZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ.dat | 20 ++++++++++++++++++++ Data/scan_BF_VTZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_BF_VTZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_BF_VTZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_Be2_VDZ.dat | 31 +++++++++++++++++++++++++++++++ Data/scan_CO_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_CC2.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_CC3.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_CCSD.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_FC_CC2.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_FC_CC3.dat | 20 ++++++++++++++++++++ Data/scan_CO_VDZ_FC_CCSD.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ.dat | 21 +++++++++++++++++++++ Data/scan_CO_VTZ_CC2.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_CC3.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_CCSD.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_FC_CC2.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_FC_CC3.dat | 20 ++++++++++++++++++++ Data/scan_CO_VTZ_FC_CCSD.dat | 20 ++++++++++++++++++++ Data/scan_F2_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_F2_VDZ_CC2.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VDZ_CC3.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VDZ_CCSD.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_F2_VDZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_F2_VDZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_F2_VDZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_F2_VTZ.dat | 20 ++++++++++++++++++++ Data/scan_F2_VTZ_CC2.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VTZ_CC3.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VTZ_CCSD.dat | 24 ++++++++++++++++++++++++ Data/scan_F2_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_F2_VTZ_FC_CC2.dat | 23 +++++++++++++++++++++++ Data/scan_F2_VTZ_FC_CC3.dat | 23 +++++++++++++++++++++++ Data/scan_F2_VTZ_FC_CCSD.dat | 23 +++++++++++++++++++++++ Data/scan_H2_VDZ.dat | 25 +++++++++++++++++++++++++ Data/scan_H2_VDZ_FCI.dat | 16 ++++++++++++++++ Data/scan_H2_VQZ.dat | 25 +++++++++++++++++++++++++ Data/scan_H2_VQZ_FCI.dat | 16 ++++++++++++++++ Data/scan_H2_VTZ.dat | 25 +++++++++++++++++++++++++ Data/scan_H2_VTZ_FCI.dat | 16 ++++++++++++++++ Data/scan_HCl_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_HCl_VDZ_CC2.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VDZ_CC3.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VDZ_CCSD.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_HCl_VDZ_FC_CC2.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VDZ_FC_CC3.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VDZ_FC_CCSD.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ.dat | 20 ++++++++++++++++++++ Data/scan_HCl_VTZ_CC2.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ_CC3.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ_CCSD.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_HCl_VTZ_FC_CC2.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ_FC_CC3.dat | 23 +++++++++++++++++++++++ Data/scan_HCl_VTZ_FC_CCSD.dat | 23 +++++++++++++++++++++++ Data/scan_LiF_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_LiF_VDZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VDZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VDZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_LiF_VDZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VDZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VDZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ.dat | 25 +++++++++++++++++++++++++ Data/scan_LiF_VTZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_LiF_VTZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiF_VTZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ.dat | 25 +++++++++++++++++++++++++ Data/scan_LiH_VDZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ_FC.dat | 25 +++++++++++++++++++++++++ Data/scan_LiH_VDZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VDZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ.dat | 25 +++++++++++++++++++++++++ Data/scan_LiH_VTZ_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ_FC.dat | 25 +++++++++++++++++++++++++ Data/scan_LiH_VTZ_FC_CC2.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ_FC_CC3.dat | 26 ++++++++++++++++++++++++++ Data/scan_LiH_VTZ_FC_CCSD.dat | 26 ++++++++++++++++++++++++++ Data/scan_N2_VDZ.dat | 20 ++++++++++++++++++++ Data/scan_N2_VDZ_CC2.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VDZ_CC3.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VDZ_CCSD.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VDZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_N2_VDZ_FC_CC2.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VDZ_FC_CC3.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VDZ_FC_CCSD.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ.dat | 20 ++++++++++++++++++++ Data/scan_N2_VTZ_CC2.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ_CC3.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ_CCSD.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ_FC.dat | 20 ++++++++++++++++++++ Data/scan_N2_VTZ_FC_CC2.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ_FC_CC3.dat | 22 ++++++++++++++++++++++ Data/scan_N2_VTZ_FC_CCSD.dat | 22 ++++++++++++++++++++++ 150 files changed, 2759 insertions(+), 12 deletions(-) create mode 100644 Data/BF_GS_VDZ.pdf create mode 100644 Data/BF_GS_VDZ_FC.pdf create mode 100644 Data/BF_GS_VTZ.pdf create mode 100644 Data/BF_GS_VTZ_FC.pdf create mode 100644 Data/CO_GS_VDZ.pdf create mode 100644 Data/CO_GS_VDZ_FC.pdf create mode 100644 Data/CO_GS_VTZ.pdf create mode 100644 Data/CO_GS_VTZ_FC.pdf create mode 100644 Data/F2_GS_VDZ.pdf create mode 100644 Data/F2_GS_VDZ_FC.pdf create mode 100644 Data/F2_GS_VTZ.pdf create mode 100644 Data/H2_GS_VDZ.pdf create mode 100644 Data/H2_GS_VQZ.pdf create mode 100644 Data/H2_GS_VTZ.pdf create mode 100644 Data/HCl_GS_VDZ.pdf create mode 100644 Data/HCl_GS_VDZ_FC.pdf create mode 100644 Data/HCl_GS_VTZ.pdf create mode 100644 Data/HCl_GS_VTZ_FC.pdf create mode 100644 Data/LiF_GS_VDZ.pdf create mode 100644 Data/LiF_GS_VDZ_FC.pdf create mode 100644 Data/LiF_GS_VTZ.pdf create mode 100644 Data/LiF_GS_VTZ_FC.pdf create mode 100644 Data/LiH_GS_VDZ.pdf create mode 100644 Data/LiH_GS_VDZ_FC.pdf create mode 100644 Data/LiH_GS_VTZ.pdf create mode 100644 Data/LiH_GS_VTZ_FC.pdf create mode 100644 Data/N2_GS_VDZ.pdf create mode 100644 Data/N2_GS_VDZ_FC.pdf create mode 100644 Data/N2_GS_VTZ.pdf create mode 100644 Data/N2_GS_VTZ_FC.pdf create mode 100644 Data/scan_BF_VDZ.dat create mode 100644 Data/scan_BF_VDZ_CC2.dat create mode 100644 Data/scan_BF_VDZ_CC3.dat create mode 100644 Data/scan_BF_VDZ_CCSD.dat create mode 100644 Data/scan_BF_VDZ_FC.dat create mode 100644 Data/scan_BF_VDZ_FC_CC2.dat create mode 100644 Data/scan_BF_VDZ_FC_CC3.dat create mode 100644 Data/scan_BF_VDZ_FC_CCSD.dat create mode 100644 Data/scan_BF_VTZ.dat create mode 100644 Data/scan_BF_VTZ_CC2.dat create mode 100644 Data/scan_BF_VTZ_CC3.dat create mode 100644 Data/scan_BF_VTZ_CCSD.dat create mode 100644 Data/scan_BF_VTZ_FC.dat create mode 100644 Data/scan_BF_VTZ_FC_CC2.dat create mode 100644 Data/scan_BF_VTZ_FC_CC3.dat create mode 100644 Data/scan_BF_VTZ_FC_CCSD.dat create mode 100644 Data/scan_Be2_VDZ.dat create mode 100644 Data/scan_CO_VDZ.dat create mode 100644 Data/scan_CO_VDZ_CC2.dat create mode 100644 Data/scan_CO_VDZ_CC3.dat create mode 100644 Data/scan_CO_VDZ_CCSD.dat create mode 100644 Data/scan_CO_VDZ_FC.dat create mode 100644 Data/scan_CO_VDZ_FC_CC2.dat create mode 100644 Data/scan_CO_VDZ_FC_CC3.dat create mode 100644 Data/scan_CO_VDZ_FC_CCSD.dat create mode 100644 Data/scan_CO_VTZ.dat create mode 100644 Data/scan_CO_VTZ_CC2.dat create mode 100644 Data/scan_CO_VTZ_CC3.dat create mode 100644 Data/scan_CO_VTZ_CCSD.dat create mode 100644 Data/scan_CO_VTZ_FC.dat create mode 100644 Data/scan_CO_VTZ_FC_CC2.dat create mode 100644 Data/scan_CO_VTZ_FC_CC3.dat create mode 100644 Data/scan_CO_VTZ_FC_CCSD.dat create mode 100644 Data/scan_F2_VDZ.dat create mode 100644 Data/scan_F2_VDZ_CC2.dat create mode 100644 Data/scan_F2_VDZ_CC3.dat create mode 100644 Data/scan_F2_VDZ_CCSD.dat create mode 100644 Data/scan_F2_VDZ_FC.dat create mode 100644 Data/scan_F2_VDZ_FC_CC2.dat create mode 100644 Data/scan_F2_VDZ_FC_CC3.dat create mode 100644 Data/scan_F2_VDZ_FC_CCSD.dat create mode 100644 Data/scan_F2_VTZ.dat create mode 100644 Data/scan_F2_VTZ_CC2.dat create mode 100644 Data/scan_F2_VTZ_CC3.dat create mode 100644 Data/scan_F2_VTZ_CCSD.dat create mode 100644 Data/scan_F2_VTZ_FC.dat create mode 100644 Data/scan_F2_VTZ_FC_CC2.dat create mode 100644 Data/scan_F2_VTZ_FC_CC3.dat create mode 100644 Data/scan_F2_VTZ_FC_CCSD.dat create mode 100644 Data/scan_H2_VDZ.dat create mode 100644 Data/scan_H2_VDZ_FCI.dat create mode 100644 Data/scan_H2_VQZ.dat create mode 100644 Data/scan_H2_VQZ_FCI.dat create mode 100644 Data/scan_H2_VTZ.dat create mode 100644 Data/scan_H2_VTZ_FCI.dat create mode 100644 Data/scan_HCl_VDZ.dat create mode 100644 Data/scan_HCl_VDZ_CC2.dat create mode 100644 Data/scan_HCl_VDZ_CC3.dat create mode 100644 Data/scan_HCl_VDZ_CCSD.dat create mode 100644 Data/scan_HCl_VDZ_FC.dat create mode 100644 Data/scan_HCl_VDZ_FC_CC2.dat create mode 100644 Data/scan_HCl_VDZ_FC_CC3.dat create mode 100644 Data/scan_HCl_VDZ_FC_CCSD.dat create mode 100644 Data/scan_HCl_VTZ.dat create mode 100644 Data/scan_HCl_VTZ_CC2.dat create mode 100644 Data/scan_HCl_VTZ_CC3.dat create mode 100644 Data/scan_HCl_VTZ_CCSD.dat create mode 100644 Data/scan_HCl_VTZ_FC.dat create mode 100644 Data/scan_HCl_VTZ_FC_CC2.dat create mode 100644 Data/scan_HCl_VTZ_FC_CC3.dat create mode 100644 Data/scan_HCl_VTZ_FC_CCSD.dat create mode 100644 Data/scan_LiF_VDZ.dat create mode 100644 Data/scan_LiF_VDZ_CC2.dat create mode 100644 Data/scan_LiF_VDZ_CC3.dat create mode 100644 Data/scan_LiF_VDZ_CCSD.dat create mode 100644 Data/scan_LiF_VDZ_FC.dat create mode 100644 Data/scan_LiF_VDZ_FC_CC2.dat create mode 100644 Data/scan_LiF_VDZ_FC_CC3.dat create mode 100644 Data/scan_LiF_VDZ_FC_CCSD.dat create mode 100644 Data/scan_LiF_VTZ.dat create mode 100644 Data/scan_LiF_VTZ_CC2.dat create mode 100644 Data/scan_LiF_VTZ_CC3.dat create mode 100644 Data/scan_LiF_VTZ_CCSD.dat create mode 100644 Data/scan_LiF_VTZ_FC.dat create mode 100644 Data/scan_LiF_VTZ_FC_CC2.dat create mode 100644 Data/scan_LiF_VTZ_FC_CC3.dat create mode 100644 Data/scan_LiF_VTZ_FC_CCSD.dat create mode 100644 Data/scan_LiH_VDZ.dat create mode 100644 Data/scan_LiH_VDZ_CC2.dat create mode 100644 Data/scan_LiH_VDZ_CC3.dat create mode 100644 Data/scan_LiH_VDZ_CCSD.dat create mode 100644 Data/scan_LiH_VDZ_FC.dat create mode 100644 Data/scan_LiH_VDZ_FC_CC2.dat create mode 100644 Data/scan_LiH_VDZ_FC_CC3.dat create mode 100644 Data/scan_LiH_VDZ_FC_CCSD.dat create mode 100644 Data/scan_LiH_VTZ.dat create mode 100644 Data/scan_LiH_VTZ_CC2.dat create mode 100644 Data/scan_LiH_VTZ_CC3.dat create mode 100644 Data/scan_LiH_VTZ_CCSD.dat create mode 100644 Data/scan_LiH_VTZ_FC.dat create mode 100644 Data/scan_LiH_VTZ_FC_CC2.dat create mode 100644 Data/scan_LiH_VTZ_FC_CC3.dat create mode 100644 Data/scan_LiH_VTZ_FC_CCSD.dat create mode 100644 Data/scan_N2_VDZ.dat create mode 100644 Data/scan_N2_VDZ_CC2.dat create mode 100644 Data/scan_N2_VDZ_CC3.dat create mode 100644 Data/scan_N2_VDZ_CCSD.dat create mode 100644 Data/scan_N2_VDZ_FC.dat create mode 100644 Data/scan_N2_VDZ_FC_CC2.dat create mode 100644 Data/scan_N2_VDZ_FC_CC3.dat create mode 100644 Data/scan_N2_VDZ_FC_CCSD.dat create mode 100644 Data/scan_N2_VTZ.dat create mode 100644 Data/scan_N2_VTZ_CC2.dat create mode 100644 Data/scan_N2_VTZ_CC3.dat create mode 100644 Data/scan_N2_VTZ_CCSD.dat create mode 100644 Data/scan_N2_VTZ_FC.dat create mode 100644 Data/scan_N2_VTZ_FC_CC2.dat create mode 100644 Data/scan_N2_VTZ_FC_CC3.dat create mode 100644 Data/scan_N2_VTZ_FC_CCSD.dat diff --git a/BSE-PES.tex b/BSE-PES.tex index fda8698..5a4d490 100644 --- a/BSE-PES.tex +++ b/BSE-PES.tex @@ -430,18 +430,18 @@ Equilibrium distances (in bohr) of the ground state of diatomic molecules obtain MP2 & cc-pVDZ & 1.426 & 3.041 & 3.010 & 2.133 & 2.166 & 2.431 & 2.681 & 2.426 \\ & cc-pVTZ & 1.393 & 3.004 & 2.968 & 2.095 & 2.144 & 2.383 & 2.636 & 2.405 \\ & cc-pVQZ & 1.391 & 3.008 & 2.970 & 2.091 & 2.137 & 2.382 & 2.634 & 2.395 \\ - BSE@{\GOWO}@HF & cc-pVDZ & 1.437 & 3.042 & 2.999 & 2.107 & 2.153 & & & \\ - & cc-pVTZ & 1.404 & 3.023 & glitch & & & & & \\ - & cc-pVQZ & 1.399 & & & & & & & \\ - RPA@{\GOWO}@HF & cc-pVDZ & 1.426 & 3.019 & 2.994 & 2.083 & 2.144 & & & \\ - & cc-pVTZ & 1.388 & 3.013 & glitch & & & & & \\ - & cc-pVQZ & 1.382 & & & & & & & \\ - RPAx@HF & cc-pVDZ & 1.428 & 3.040 & 2.998 & 2.077 & 2.130 & & & \\ - & cc-pVTZ & 1.395 & 3.003 & <2.990 & & & & & \\ - & cc-pVQZ & 1.394 & & & & & & & \\ - RPA@HF & cc-pVDZ & 1.431 & 3.021 & 2.999 & 2.083 & 2.134 & & & \\ - & cc-pVTZ & 1.388 & 2.978 & <2.990 & & & & & \\ - & cc-pVQZ & 1.386 & & & & & & & \\ + BSE@{\GOWO}@HF & cc-pVDZ & 1.437 & 3.042 & 2.999 & 2.107 & 2.153 & 2.416 & & 2.437 \\ + & cc-pVTZ & 1.404 & 3.023 & glitch & & & 2.437 & & \\ + & cc-pVQZ & 1.399 & & & & & & & \\ + RPA@{\GOWO}@HF & cc-pVDZ & 1.426 & 3.019 & 2.994 & 2.083 & 2.144 & 2.403 & & 2.436 \\ + & cc-pVTZ & 1.388 & 3.013 & glitch & & & <2.420 & & \\ + & cc-pVQZ & 1.382 & & & & & & & \\ + RPAx@HF & cc-pVDZ & 1.428 & 3.040 & 2.998 & 2.077 & 2.130 & 2.417 & & 2.424 \\ + & cc-pVTZ & 1.395 & 3.003 & <2.990 & & & <2.420 & & \\ + & cc-pVQZ & 1.394 & & & & & & & \\ + RPA@HF & cc-pVDZ & 1.431 & 3.021 & 2.999 & 2.083 & 2.134 & & & 2.424 \\ + & cc-pVTZ & 1.388 & 2.978 & <2.990 & & & 2.416 & & \\ + & cc-pVQZ & 1.386 & & & & & <2.420 & & \\ % FROZEN CORE VERSION % Method & Basis & \ce{H2} & \ce{LiH}& \ce{LiF}& \ce{N2} & \ce{CO} & \ce{BF} & \ce{F2} & \ce{HCl}\\ % \hline diff --git a/Data/BF_GS_VDZ.pdf b/Data/BF_GS_VDZ.pdf new file mode 100644 index 0000000000000000000000000000000000000000..9c17434253e0d5c0c8669764c60dbcc1da713cb0 GIT binary patch literal 49439 zcmYhib95%n7cCqwR)YZ-gRo% 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