↓ ID ✕ | PBC ✕ | Dipole_val ✕ |
---|---|---|
101 | TTT | -6.067 |
102 | TTT | -3.492 |
103 | TTT | -1.522 |
104 | TTT | -0.561 |
105 | TTT | 0.405 |
106 | TTT | 1.306 |
107 | TTT | 1.286 |
108 | TTT | -0.163 |
109 | TTT | 0.312 |
110 | TTT | -0.024 |
111 | TTT | -5.675 |
112 | TTT | -1.886 |
113 | TTT | 0.023 |
114 | TTT | 0.775 |
115 | TTT | 1.821 |
116 | TTT | 2.735 |
117 | TTT | 2.894 |
118 | TTT | -0.020 |
119 | TTT | -6.877 |
120 | TTT | -3.881 |
121 | TTT | -2.381 |
122 | TTT | -1.395 |
123 | TTT | 0.382 |
124 | TTT | 2.053 |
125 | TTT | 2.575 |