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YESENIA ALFARO

ECUACIÓN DE SCHRÖDINGER EN COORDENADAS ESFÉRICAS


−ℏ2 2 ∂Ψ
∇ Ψ +VΨ =iℏ
2m ∂t
∂ ∂ ∂
∇= êx + ê y + êz
∂x ∂y ∂z
Coordenadas esféricas Ψ ( r , θ , ϕ)

∂Ψ ∂Ψ ∂ r ∂ Ψ ∂θ ∂ Ψ ∂ ϕ
= ∙ + ∙ + ∙
∂ x ∂r ∂ x ∂ θ ∂ x ∂ ϕ ∂ x
∂Ψ ∂Ψ ∂ r ∂ Ψ ∂θ ∂Ψ ∂ ϕ
= ∙ + ∙ + ∙
∂ y ∂r ∂ y ∂ ϕ ∂ y ∂ ϕ ∂ y
∂Ψ ∂Ψ ∂ r ∂ Ψ ∂ θ ∂Ψ ∂ ϕ
= ∙ + ∙ + ∙
∂ z ∂r ∂ z ∂ θ ∂ z ∂ ϕ ∂ z
Las componentes según la geometría del sistema (esférico) :

x=rsenθ ∙cos ϕ y=rsenθ ∙ sen ϕ z=rcosθ


YESENIA ALFARO

√ x 2+ y 2
2
r =√ x + y + z 2 2
;θ=tan −1 ( z ) ;∅=tan
−1
( yx )

∂r x rsenθ ∙cos ϕ
= 2 2 2= =senθ ∙ cos ϕ
∂x √ x + y +z r

∂r y rsenθ ∙ sen ϕ
= 2 2 2= =senθ ∙ sen ϕ
∂ y √ x + y +z r

∂r z rcosθ
= 2 2 2= =cosθ
∂z √ x + y +z r
−1
1 2 2 2
∙( x + y ) ∙ 2 x
∂θ 1 2 z2 x cos θcos ϕ
= ∙ = ∙ =
∂x 2
x +y 2
z 2 2 2 2
x + y +z z √ x + y 2 r
1+ 2
z
−1
1 2 2 2
∙ ( x + y ) ∙2 y
∂θ 1 2 z2 y cos θsen ϕ
= ∙ = ∙ =
∂y 2
x +y 2
z 2 2 2 2
x + y +z z √x + y 2 r
1+ 2
z

∂θ 1 − √ x 2 + y 2 −√ x 2+ y 2 −sen θ
= ∙ = 2 2 2=
∂z x 2+ y 2 z2 x +y +z r
1+ 2
z
∂ϕ 1 −y −y rsenθsen ϕ −sen ϕ
∂x
=
1+
y2

2

( )
x 2
= 2 2= 2 2 =
x +y r sen θ sen θ
x
∂ϕ 1
∂y
=
y
1+ 2
2
∙ ( 1x )= x +x y = rsenθ
2 2
cos ϕ

∂ϕ
=0
∂z

Reenlazando
YESENIA ALFARO

∂Ψ ∂Ψ ∂ Ψ cos θcos ϕ ∂ Ψ −sen ϕ ∂ cos θcos ϕ ∂ −sen ϕ ∂


=
∂ x ∂r
∙ s enθ ∙ cos ϕ+
∂θ

r
+ ∙
∂ ϕ sen θ ⏟ (
= senθ ∙ cos ϕ ∙ +
∂r r
∙ + ∙
∂θ sen θ ∂ ϕ
Ψ )

∂x

∂Ψ ∂Ψ ∂Ψ cos θsen ϕ ∂Ψ cos ϕ ∂ cos θsen ϕ ∂ cos ϕ ∂


=
∂ y ∂r
∙ senθ ∙ sen ϕ+
∂θ

r
+ ∙
∂ ϕ rsenθ ⏟ (
= senθ ∙ sen ϕ ∙ +
∂r r
∙ + ∙
∂ θ rsenθ ∂ ϕ
Ψ )

∂y

∂Ψ ∂Ψ ∂ Ψ −sen θ ∂ −sen θ ∂
=
∂ z ∂r
∙ cosθ+
∂θ

r
= cosθ ∙ +
⏟ ∂ r (r

∂θ
Ψ )

∂z

2 ∂2 ∂2 ∂2 ∂ ∂ ∂ ∂ ∂ ∂
∇= 2
+ 2
+ 2
= + +
∂ x ∂ y ∂z ∂x ∂ x ∂ y ∂ y ∂z ∂ z

∂2 ∂ cos θcos ϕ ∂ −sen ϕ ∂ ∂ cos θcos ϕ ∂ −sen ϕ ∂
∂x 2(= senθ ∙ cos ϕ∙ +
∂ r r

∂ θ
+
sen θ

∂ ϕ )(
senθ ∙cos ϕ ∙ +
∂ r r
∙ + ∙
∂ θ sen θ ∂ ϕ )
∂2 ∂ 1 ∂2 −1 ∂ 1 ∂2
¿ sen2 θ cos 2 ϕ
∂ r2
+ senθcos (
ϕ
−1
r2
cos θ ∙ cos ϕ +
∂ϕ r
cos θ ∙cos ϕ )
∂ r ∂ θ2
−cos ϕ sen ϕ ( + )
r 2 ∂ ϕ r ∂ r ∂ θ2
+

2 2 ∂2 1 2 ∂ 1 2 ∂2 1 ∂2 1 2 2 ∂
¿ sen θ cos ϕ 2
− 2
senθcosθ cos ϕ + senθcosθ cos ϕ + 2
cosϕsenϕ + cos θ cos θ +
∂r r ∂θ r ∂ r ∂θ r ∂r∂ϕ r ∂r


∂2 ∂ cos ϕ sen ϕ ∂ cos ϕ ∂ ∂ cos ϕ sen ϕ ∂ cos ϕ ∂
∂y 2 (
= senθ ∙ senϕ ∙ +
∂r r
∙ + ∙
∂θ r sen θ ∂ ϕ )(
senθ ∙ senϕ ∙ +
∂r r
∙ + ∙
∂ θ r sen θ ∂ ϕ )
YESENIA ALFARO

∂2 ∂ cosθ senϕ ∂2 −1 ∂ 1 ∂2 cosθ se


¿ sen2 θ sen2 ϕ
∂r 2
+ senθsenϕ (
−1
r 2
cosθ senϕ
∂ θ
+
r ∂ r ∂ θ
+ )
senϕ cos ϕ
r (
2
∂ ϕ
+
r ∂ r ∂ ϕ)+
r

2 2 ∂2 1 2 ∂ 1 2 ∂2 1 ∂ 1 ∂2
¿ sen θ sen ϕ − senθ cosθ sen ϕ + senθ cosθ sen ϕ − senθ cosθ + senϕ cos ϕ
∂r 2 r 2 ∂θ r ∂r ∂ θ r 2 ∂ϕ r ∂r∂ϕ

∂2 ∂ −senθ ∂ ∂ −senθ ∂
 ∂z 2= (
cosθ +
∂r r
.
∂θ
cosθ +
∂r)( r
.
∂θ )
=
∂2 1
2 ∂ 1 ∂2 1 2 ∂ 1 ∂2 1
cos θ 2 + 2 senθcosθ − 2 cos θ senθ + sen θ − senθ cos θ + 2 senθcosθ
∂r r ∂θ r ∂ r ∂θ r ∂r r ∂θ∂r r

2 ∂2 ∂2 ∂2
∇= + +
∂ x2 ∂ y 2 ∂ z 2

Reemplazando

2 2 ∂2 1 2 ∂ 1 2 ∂2 1 ∂2 1 2 2 ∂
¿ sen θ cos ϕ 2
− 2
senθcosθ cos ϕ + senθcosθ cos ϕ + 2
cos ϕ senϕ + cos θ cos θ
∂r r ∂θ r ∂ r ∂θ r ∂r ∂ ϕ r ∂r

2 ∂2 2 ∂ cos θ ∂ 1 ∂2 1 ∂2
∇= + + + +
∂ r 2 r ∂ r r 2 senθ ∂θ r 2 ∂θ 2 r 2 sen2 θ ∂ ϕ

1 ∂ψ 2 ∂ψ 1 ∂ ∂ψ 1 ∂2ψ
2
∇ ψ=
r2 ∂r
r ( + )
∂ r r 2 senθ ∂ θ
senθ (+ )
∂ θ r 2 sen 2 θ ∂ ϕ
Reemplazamos a la ecuación de Schrödinger

−ℏ2 1 ∂ ψ 2 ∂ ψ 1 ∂ ∂ψ 1 ∂2 ψ ∂ψ
2[ ( )
2m r ∂ r
r + 2
∂ r r senθ ∂ θ
senθ + 2( 2
∂θ r sen θ ∂ ϕ )
Vψ=iℏ
∂t ]

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