Preface |
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xi | |
Authors |
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xiii | |
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1 The role of numerical methods in engineering |
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1 | (10) |
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1 | (2) |
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1.2 Fields of application |
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3 | (1) |
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1.3 Future progress and trends |
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3 | (8) |
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5 | (3) |
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8 | (3) |
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2 Numerical analysis and weighted residuals |
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11 | (26) |
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11 | (1) |
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2.2 Approximation problem (Trial functions; Norms or measures of error) |
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12 | (1) |
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2.3 Method of weighted residuals (Ordinary differential equations) |
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13 | (6) |
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2.3.1 Preliminary remarks |
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13 | (1) |
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2.3.2 Method of weighted residuals |
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14 | (3) |
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17 | (1) |
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2.3.4 Convergence theorems |
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17 | (2) |
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2.4 Method of weighted residuals (Partial differential equations) |
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19 | (4) |
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21 | (1) |
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22 | (1) |
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2.5 Variation method (Rayleigh--Ritz method) |
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23 | (5) |
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2.5.1 Approximation techniques based on variational methods |
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25 | (3) |
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2.6 Ritz method revisited and Trefftz method |
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28 | (9) |
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2.6.1 Ritz method applied to a rectangular cross-section |
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29 | (1) |
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2.6.2 First approximation |
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30 | (2) |
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2.6.3 Second approximation |
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32 | (1) |
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2.6.4 Trefftz method applied to a rectangular cross-section |
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32 | (2) |
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2.6.5 Bounds on torsion solution |
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34 | (1) |
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35 | (1) |
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36 | (1) |
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3 Finite difference methods |
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37 | (36) |
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3.1 Preliminary remarks and concepts |
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37 | (1) |
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3.1.1 Finite differences, finite elements, and weighted residual methods |
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38 | (1) |
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3.2 Divided differences and interpolation formulas |
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38 | (10) |
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3.2.1 Newton's forward and backward interpolation polynomials |
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44 | (1) |
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3.2.2 Newton--Gauss interpolation polynomial |
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45 | (2) |
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3.2.3 Stirling's central interpretation polynomial |
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47 | (1) |
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3.3 Approximate expressions for derivatives |
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48 | (6) |
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3.4 Two-dimensional harmonic equation, biharmonic equation, and curved boundaries |
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54 | (6) |
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57 | (1) |
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3.4.2 Biharmonic equation |
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57 | (1) |
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58 | (2) |
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3.5 Finite difference approximation of the plane stress problem |
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60 | (4) |
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64 | (9) |
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3.6.1 Square cross-section |
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65 | (1) |
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3.6.2 Bar with elliptical cross-section |
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66 | (3) |
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Appendix 3A Derivation of Equation 3.16 |
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69 | (1) |
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Appendix 3B Derivation of Equation 3.38 |
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70 | (1) |
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71 | (1) |
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71 | (2) |
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4 The finite element method |
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73 | (64) |
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73 | (2) |
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4.1.1 Analytical perspective |
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73 | (1) |
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74 | (1) |
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4.2 Formulation for plane elasticity |
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75 | (19) |
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4.2.1 Elasticity concepts |
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75 | (3) |
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4.2.2 Displacement interpolation: Constant-strain triangle |
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78 | (3) |
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4.2.3 Element stiffness matrix: CST |
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81 | (3) |
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4.2.4 Equivalent nodal load vector: CST |
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84 | (3) |
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4.2.5 Assembly of the structure stiffness matrix and load vector |
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87 | (3) |
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4.2.6 Application of constraints |
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90 | (3) |
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4.2.7 Solution of the system of equations |
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93 | (1) |
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94 | (7) |
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4.4 Linear isoparametric quadrilateral |
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101 | (7) |
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4.4.1 Isoparametric mapping |
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102 | (2) |
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4.4.2 Element stiffness matrix |
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104 | (1) |
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4.4.3 Numerical integration |
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105 | (2) |
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4.4.4 High-order isoparametric elements |
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107 | (1) |
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108 | (9) |
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4.5.1 Element stiffness matrix |
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108 | (5) |
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4.5.2 Equivalent nodal load vector |
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113 | (1) |
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4.5.3 Coordinate rotations |
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114 | (3) |
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117 | (11) |
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4.6.1 Three-dimensional isoparametric elements |
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117 | (1) |
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4.6.2 Equilibrium equation |
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118 | (3) |
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121 | (1) |
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4.6.4 Nonlocal elasticity |
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121 | (2) |
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123 | (4) |
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4.6.6 Finite strain theory |
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127 | (1) |
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128 | (4) |
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4.7.1 Requirements for accuracy |
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128 | (1) |
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4.7.2 Requirements for convergence |
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129 | (1) |
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4.7.3 Modeling recommendations |
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130 | (2) |
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132 | (5) |
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132 | (1) |
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133 | (1) |
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134 | (1) |
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135 | (1) |
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135 | (2) |
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137 | (20) |
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137 | (1) |
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137 | (3) |
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5.3 Formulation of the FSM |
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140 | (3) |
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143 | (1) |
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144 | (3) |
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147 | (2) |
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5.7 Applications and developments of FSM, FLM, and FPM |
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149 | (8) |
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152 | (2) |
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154 | (3) |
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6 The boundary element method |
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157 | (34) |
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157 | (2) |
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6.2 Integrals in the boundary element method |
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159 | (2) |
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6.3 Equations of elasticity |
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161 | (1) |
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6.4 Fundamental or Kelvin's solution |
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162 | (2) |
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6.5 Boundary element formulation |
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164 | (3) |
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6.6 Displacement and traction interpolation |
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167 | (3) |
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6.7 Element contributions |
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170 | (2) |
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6.8 Assembly of boundary element matrices |
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172 | (2) |
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174 | (1) |
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6.10 Solution of boundary element equations |
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175 | (1) |
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6.11 Displacement at points in the interior |
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176 | (1) |
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177 | (1) |
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6.13 Particular integral approach |
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177 | (2) |
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6.14 Evaluation of stresses and strains |
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179 | (3) |
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6.15 Corner problem in the boundary element method |
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182 | (3) |
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185 | (6) |
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186 | (3) |
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189 | (2) |
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7 Meshless methods of analysis |
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191 | (34) |
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191 | (1) |
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7.2 Equations of elasticity |
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192 | (1) |
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7.3 Weak forms of the governing equations |
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192 | (2) |
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7.4 Moving least squares approximations |
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194 | (5) |
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7.5 Characteristics of MLS approximation |
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199 | (1) |
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200 | (2) |
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7.7 Discrete EFG formulation |
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202 | (7) |
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7.8 Numerical implementation |
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209 | (2) |
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7.9 Treatment of boundary conditions |
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211 | (4) |
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7.10 Other methods for meshless analysis |
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215 | (2) |
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217 | (3) |
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218 | (1) |
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219 | (1) |
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220 | (5) |
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221 | (3) |
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224 | (1) |
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8 Multiphysics in molecular dynamics simulation |
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225 | (40) |
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225 | (1) |
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226 | (2) |
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8.3 Interatomic potentials for ionic crystals |
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228 | (3) |
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8.3.1 Lennard--Jones potential |
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229 | (1) |
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8.3.2 Coulomb--Buckingham potential |
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229 | (2) |
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8.4 Interatomic potentials for 2D materials |
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231 | (7) |
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231 | (1) |
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232 | (3) |
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8.4.3 Molybdenum disulfide |
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235 | (1) |
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8.4.3.1 Interatomic potentials for Mo--S systems |
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235 | (3) |
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238 | (3) |
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8.6 Reformulation of Nose--Hoover thermostat |
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241 | (6) |
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8.6.1 Hamiltonian of the material system |
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245 | (2) |
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8.7 Microscopic Maxwell's equations and Lorentz force |
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247 | (4) |
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8.7.1 Microscopic Maxwell's equations |
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247 | (1) |
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8.7.2 Scalar and vector potentials |
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248 | (1) |
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8.7.3 Nonrelativistic EM fields |
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249 | (1) |
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8.7.4 Equation of motion of a point particle |
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250 | (1) |
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251 | (3) |
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8.9 Numerical results of a sample problem |
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254 | (2) |
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256 | (9) |
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Appendix: Lorentz transformation |
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256 | (4) |
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260 | (3) |
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263 | (2) |
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9 Multiscale modeling from atoms to genuine continuum |
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265 | (38) |
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265 | (1) |
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266 | (3) |
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269 | (5) |
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9.3.1 General dynamical matrix |
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271 | (3) |
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274 | (5) |
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9.4.1 Nose--Hoover thermostat in the ABC region |
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274 | (3) |
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9.4.2 Hamiltonian of AAMD CGMD |
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277 | (2) |
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9.5 Sequential multiscale modeling from MD to thermoelasticity |
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279 | (7) |
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9.5.1 Thermoelasticity and sequential multiscale modeling |
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279 | (2) |
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9.5.2 Material constants from MD simulation |
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281 | (1) |
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9.5.2.1 Elastic constants |
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282 | (2) |
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9.5.2.2 Thermal conductivity |
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284 | (1) |
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9.5.2.3 Specific heat and thermal expansion coefficients |
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285 | (1) |
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9.6 Concurrent multiscale modeling from MD to CM |
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286 | (12) |
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9.6.1 One specimen, two regions |
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286 | (2) |
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9.6.2 Inter facial conditions |
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288 | (1) |
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9.6.3 Multiple time scale algorithm |
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289 | (3) |
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9.6.4 Sample problems and numerical results |
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292 | (1) |
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9.6.4.1 Material constants obtained from MD simulations |
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292 | (1) |
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293 | (5) |
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298 | (5) |
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300 | (1) |
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301 | (2) |
Author Index |
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303 | (8) |
Subject Index |
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311 | |