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eV cm MeV
Page 11: eV
Page 15 and 16: eV
Page 17: 6 − 311 + +G(3df, 3pd)
Page 21 and 22: CH4
Page 23 and 24: eV eV
Page 25: eV
Page 28 and 29: HMΨ 0 (r, R; t) = i ∂ ∂t Ψ0 (
Page 30 and 31: N M H ele = − N j=1 2 2m
Page 32 and 33: M − 2 ∇ 2ML 2 L + Vn(R) n L
Page 34 and 35: E
Page 36 and 37: E(r, t) B(r, t) ρ(r, t)
Page 38 and 39: 2πN A0 = 2c ωV 1 2
Page 40 and 41: H ′ (t) = i M eZL A(RL, t) ·
Page 42 and 43: α −i d dt (aα(t)) ψ 0 iEαt
Page 44 and 45: Mα ′ i = ψ 0 α ′ ∗ − N
Page 46 and 47: ω ψ 0 i (r, R)
Page 50 and 51: e v E B F = e(E
Page 52 and 53: S = c 4π [E2 n] r ′
Page 54 and 55: P (t ′ ) = 2 e 3 2 | ˙v| 2 c3 γ
Page 56 and 57: m m 10 −9 10
Page 58 and 59: eV
Page 60 and 61: 4
Page 62 and 63: EI EII
Page 64 and 65: tII = v2 2q 0I + m (EIS0 + EIId)
Page 66 and 67: α β
Page 68 and 69: eV
Page 70 and 71: eV
Page 72 and 73: N M N j=1 −
Page 74 and 75: E ′ 0 < E0 − ρ(r)[v(r1
Page 76 and 77: F [ρ] = Ts[ρ] + UH[ρ] + Eex[ρ]
Page 78 and 79: E0 = N i εi − e2 2 ρ0(r1)ρ0(
Page 80 and 81: B3LY P Exc = E LDA xc + a0(E HF x
Page 82 and 83: vs[ρ(r1, t)] i ∂
Page 84 and 85: χ(r, r, ω) χ
Page 86 and 87: 6 − 311 + +G(3df, 3pd)
Page 88 and 89: 11, 12 22, 01 eV 0, 015 eV
Page 90 and 91: HCOOHH + HCOOH + COOH + (HCOO
Page 92 and 93: eV
Page 94 and 95: eV
Page 96 and 97: ◦ ◦ ◦ ◦ ◦ ◦ ◦
Page 98 and 99:
◦ ◦ ◦ ◦ ◦ ◦ ◦
Page 100 and 101:
=
Page 102 and 103:
eV 1 2 A ′ 1 2 A ′
Page 104 and 105:
eV + +
Page 106 and 107:
eV + − + e − +
Page 108 and 109:
et al.
Page 111 and 112:
+ e − 30, 4% + 2 +
Page 113:
E{n1,...,n9} = Eeletronica + 9 ωi
Page 116 and 117:
+ + + + + 2 + 2
Page 118 and 119:
+
Page 120 and 121:
+
Page 122:
+
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