Element = Lattice = Model = Element: Cs Lattice: hcp Model: Pair_Morse_Shifted_GirifalcoWeizer_MedCutoff_Cs__MO_999639780744_001 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: -0.784155 Iterations: 39 Function evaluations: 84 Tmp Lattice Constants: [ 5.44119921] Tmp Energy: -0.784154598436 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.25] Optimization terminated successfully. Current function value: -0.784155 Iterations: 42 Function evaluations: 91 Tmp Lattice Constants: [ 5.44119921] Tmp Energy: -0.784154598436 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.5] Optimization terminated successfully. Current function value: -0.784155 Iterations: 39 Function evaluations: 82 Tmp Lattice Constants: [ 5.44119921] Tmp Energy: -0.784154598436 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [2.75] Optimization terminated successfully. Current function value: -0.784155 Iterations: 40 Function evaluations: 86 Tmp Lattice Constants: [ 5.44119917] Tmp Energy: -0.784154598436 -------- Simplex search starting from: 5.0 * 0 Simplex search starting from: [3.0] Optimization terminated successfully. Current function value: -0.784155 Iterations: 42 Function evaluations: 93 Tmp Lattice Constants: [ 5.44119927] Tmp Energy: -0.784154598436 -------- ERR: Lower energy is obtained by separating atoms beyond cutoff. ERR: System Collapsed. Structure Maybe Unstable.