Element = Lattice = Model = Element: Cs Lattice: hcp Model: Morse_Shifted_GirifalcoWeizer_1959LowCutoff_Cs__MO_256406354561_002 Relaxation with c/a ratio fixed Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.0] Creating new atoms: (1, 1, 1) Optimization terminated successfully. Current function value: -0.714319 Iterations: 40 Function evaluations: 86 Tmp Lattice Constants: [5.56174863] Tmp Energy: -0.7143188659843829 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.25] Optimization terminated successfully. Current function value: -0.714319 Iterations: 40 Function evaluations: 86 Tmp Lattice Constants: [5.56174874] Tmp Energy: -0.714318865984385 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.5] Optimization terminated successfully. Current function value: -0.714319 Iterations: 42 Function evaluations: 93 Tmp Lattice Constants: [5.56174853] Tmp Energy: -0.7143188659843829 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.75] Optimization terminated successfully. Current function value: -0.714319 Iterations: 40 Function evaluations: 87 Tmp Lattice Constants: [5.5617487] Tmp Energy: -0.7143188659843823 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [3.0] Optimization terminated successfully. Current function value: -0.714319 Iterations: 38 Function evaluations: 81 Tmp Lattice Constants: [5.56174866] Tmp Energy: -0.7143188659843824 -------- ERR: Lower energy is obtained by separating atoms beyond cutoff. ERR: System Collapsed. Structure Maybe Unstable.