User contributions for Ftran

14:4914:49, 7 February 2024 diff hist −8‎ LIBMBD TS D ‎No edit summary
14:4814:48, 7 February 2024 diff hist +1,251‎ N LIBMBD TS D ‎ Created page with "{{DISPLAYTITLE:LIBMBD_TS_D}} {{TAGDEF|LIBMBD_TS_D|[real]|default set by the exchange-correlation functional chosen with {{TAG|LIBMBD_XC}}}} Description: {{TAG|LIBMBD_TS_D}} sets the number of points on the grid of imaginary frequencies used in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_N_OMEGA_GRID}} allows to choose the number of points on the grid of imaginary frequencies used in the..."
14:4514:45, 7 February 2024 diff hist −21‎ LIBMBD XC ‎No edit summary
14:4014:40, 7 February 2024 diff hist −1‎ LIBMBD XC ‎No edit summary
14:3814:38, 7 February 2024 diff hist +5‎ LIBMBD XC ‎No edit summary
14:3614:36, 7 February 2024 diff hist +4‎ LIBMBD XC ‎No edit summary
14:3514:35, 7 February 2024 diff hist +424‎ LIBMBD XC ‎No edit summary
14:1514:15, 7 February 2024 diff hist +42‎ LIBMBD XC ‎No edit summary
14:1514:15, 7 February 2024 diff hist +42‎ LIBMBD XC ‎No edit summary
14:1014:10, 7 February 2024 diff hist −65‎ LIBMBD XC ‎No edit summary
13:5913:59, 7 February 2024 diff hist +27‎ LIBMBD XC ‎No edit summary
13:5813:58, 7 February 2024 diff hist +46‎ LIBMBD XC ‎No edit summary
13:4413:44, 7 February 2024 diff hist −37‎ LIBMBD XC ‎No edit summary
13:3913:39, 7 February 2024 diff hist +1,348‎ N LIBMBD XC ‎ Created page with "{{DISPLAYTITLE:LIBMBD_XC}} {{TAGDEF|LIBMBD_XC|[array of three integers]|determined in libMBD according to the cell shape}} Description: {{TAG|LIBMBD_XC}} sets the k-mesh of the collective oscillations defined in the methods available in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_XC}} allows to choose the k-mesh of the collective oscillations defined in the methods available in the libr..."
13:3713:37, 7 February 2024 diff hist +12‎ LIBMBD K GRID ‎No edit summary
13:3413:34, 7 February 2024 diff hist +78‎ LIBMBD K GRID ‎No edit summary
13:3013:30, 7 February 2024 diff hist +2‎ LIBMBD K GRID SHIFT ‎No edit summary
13:2913:29, 7 February 2024 diff hist +2‎ LIBMBD N OMEGA GRID ‎No edit summary
13:2713:27, 7 February 2024 diff hist −1‎ LIBMBD K GRID ‎No edit summary
13:2713:27, 7 February 2024 diff hist +35‎ LIBMBD K GRID ‎No edit summary
13:2513:25, 7 February 2024 diff hist +1,244‎ N LIBMBD K GRID ‎ Created page with "{{DISPLAYTITLE:LIBMBD_K_GRID}} {{TAGDEF|LIBMBD_K_GRID|[real]|0.5 (default in libMBD)}} Description: {{TAG|LIBMBD_K_GRID}} is the shift for the k-mesh of the collective oscillations defined in the methods available in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_K_GRID}} allows to choose a shift for the k-mesh of the collective oscillations defined in the methods available in the library..."
13:2113:21, 7 February 2024 diff hist +48‎ LIBMBD K GRID SHIFT ‎No edit summary
13:2013:20, 7 February 2024 diff hist −14‎ LIBMBD METHOD ‎No edit summary
13:0213:02, 7 February 2024 diff hist +1,226‎ N LIBMBD K GRID SHIFT ‎ Created page with "{{DISPLAYTITLE:LIBMBD_K_GRID_SHIFT}} {{TAGDEF|LIBMBD_K_GRID_SHIFT|[integer]|15 (default in libMBD)}} Description: {{TAG|LIBMBD_K_GRID_SHIFT}} is the number of points on the grid of imaginary frequencies used in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_N_OMEGA_GRID}} allows to choose the number of points on the grid of imaginary frequencies used in the library libMBD of many-body disp..."
12:5712:57, 7 February 2024 diff hist +14‎ LIBMBD N OMEGA GRID ‎No edit summary
12:5612:56, 7 February 2024 diff hist +6‎ LIBMBD N OMEGA GRID ‎No edit summary
12:5412:54, 7 February 2024 diff hist −24‎ LIBMBD N OMEGA GRID ‎No edit summary
12:4912:49, 7 February 2024 diff hist −35‎ LIBMBD N OMEGA GRID ‎No edit summary
11:2211:22, 7 February 2024 diff hist +8‎ LIBMBD N OMEGA GRID ‎No edit summary
11:2211:22, 7 February 2024 diff hist +7‎ LIBMBD METHOD ‎No edit summary
11:1911:19, 7 February 2024 diff hist −61‎ LIBMBD N OMEGA GRID ‎No edit summary
11:1811:18, 7 February 2024 diff hist +176‎ LIBMBD N OMEGA GRID ‎No edit summary
11:1611:16, 7 February 2024 diff hist +20‎ LIBMBD METHOD ‎No edit summary
11:1611:16, 7 February 2024 diff hist +1‎ LIBMBD N OMEGA GRID ‎No edit summary
11:1511:15, 7 February 2024 diff hist +22‎ LIBMBD N OMEGA GRID ‎No edit summary
11:1211:12, 7 February 2024 diff hist 0‎ AGGAC ‎No edit summary current Tag: Manual revert
11:1111:11, 7 February 2024 diff hist −3‎ AGGAC ‎No edit summary
11:1111:11, 7 February 2024 diff hist +3‎ AGGAC ‎No edit summary
11:0911:09, 7 February 2024 diff hist 0‎ LIBMBD METHOD ‎No edit summary
11:0311:03, 7 February 2024 diff hist −24‎ LIBMBD METHOD ‎No edit summary
11:0011:00, 7 February 2024 diff hist +34‎ LIBMBD METHOD ‎No edit summary
10:4410:44, 7 February 2024 diff hist +1,119‎ N LIBMBD N OMEGA GRID ‎ Created page with "{{DISPLAYTITLE:LIBMBD_N_OMEGA_GRID}} {{TAGDEF|LIBMBD_N_OMEGA_GRID|[integer]}} Description: {{TAG|LIBMBD_N_OMEGA_GRID}} is the number of points on the grid of imaginary frequencies for the van der Waals methods available in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_METHOD}} can be set to a label (string) corresponding to one of the methods listed on the libMBD website (see '''method'''..."
10:2410:24, 7 February 2024 diff hist −1‎ ALDAX ‎No edit summary
10:2310:23, 7 February 2024 diff hist 0‎ ALDAX ‎No edit summary
10:2310:23, 7 February 2024 diff hist +182‎ ALDAX ‎No edit summary
10:2210:22, 7 February 2024 diff hist +194‎ ALDAC ‎No edit summary current

14:0814:08, 6 February 2024 diff hist −1‎ AGGAC ‎No edit summary
14:0814:08, 6 February 2024 diff hist −1‎ AGGAX ‎No edit summary
13:2313:23, 6 February 2024 diff hist −1‎ AGGAX ‎No edit summary
13:2213:22, 6 February 2024 diff hist −1‎ AGGAC ‎No edit summary

7 February 2024

6 February 2024