共 48 条
- [31] Basal stacking faults and (10(1)over-bar2) twin energies by a semi-empirical tight-binding method for zinc and cadmium PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS, 2004, 241 (11): : 2482 - 2488
- [32] CORE STRUCTURES OF NON SCREW 1/2 [111] DISLOCATIONS ON (112) PLANES IN BCC CRYSTALS .2. PEIERLS STRESSES AND EFFECTS OF AN EXTERNAL SHEAR-STRESS ON CORES JOURNAL OF PHYSICS F-METAL PHYSICS, 1975, 5 (01): : 11 - 16
- [33] An efficient implementation of Density-Functional based Tight-Binding method (DFTB) in Gaussian 03 program: The calculation of energies, gradients, vibrational frequencies and IR spectrums ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2006, 232 : 209 - 209
- [36] Investigation of Electronic Properties of MoxW1-xS2 Alloy by Tight-binding Method for Interband transition 2019 19TH INTERNATIONAL CONFERENCE ON NUMERICAL SIMULATION OF OPTOELECTRONIC DEVICES (NUSOD 2019), 2019, : 121 - 122
- [37] Relativistic parametrization of the self-consistent-charge density-functional tight-binding method.: 1.: Atomic wave functions and energies JOURNAL OF PHYSICAL CHEMISTRY A, 2007, 111 (26): : 5712 - 5719
- [39] EMPIRICAL TIGHT-BINDING TOTAL ELECTRONIC-ENERGY CALCULATION FOR SINH2M (N = 1 TO 6, M = 1 TO 3) CLUSTERS PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1993, 177 (02): : 373 - 378