Lecture 3: The Time Dependent Schrödinger Equation The material in this lecture is not covered in Atkins. It is required to understand postulate 6 and 11.5 The informtion of a wavefunction Lecture on-line The Time Dependent Schrödinger Equation (PDF) The time Dependent Schroedinger Equation (HTML) The time dependent Schrödinger Equation (PowerPoint) Tutorials on-line The postulates of quantum mechanics (This is the writeup for Dry-lab-II ( This lecture coveres parts of postulate 6) Time Dependent Schrödinger Equation The Development of Classical Mechanics Experimental Background for Quantum mecahnics Early Development of Quantum mechanics Audio-visuals on-line review of the Schrödinger equation and the Born postulate (PDF) review of the Schrödinger equation and the Born postulate (HTML) review of Schrödinger equation and Born postulate (PowerPoint **, 1MB) Slides from the text book (From the CD included in Atkins ,**) Time Dependent Schrödinger Equation setting up equation Consider a particle of mass m that is moving in one dimension. Let its position be given by x X O V V(X,t1) V(X,t2) Let the particle be subject to the potential V(x,t) O All properties of such a particle is in quantum mechanics determined by the wavefunction (x,t) of the system Time Dependent Schrödinger Equation V(x, t) setting up equation QuickTime™ and a Video decompressor are needed to see this picture. X Time Dependent Schrödinger Equation setting up equation A system that changes with time is described by the time dependent Schrödinger equation (x,t) ˆ H(x,t) i t ˆ is the Hamiltonian of Where H the system : 2 2 ˆ H V(x, t) 2 2m x for 1D - particle according to postulate 6 Time Dependent Schrödinger Equation setting up equation (x,t) (x, t) V(x,t)(x,t) 2 i t 2m x 2 2 The time dependent Schrödinger equation The wavefunction (x, t) is also referred to as The statefunction Our state will in general change with time due to V(x,t). Thus is a function of time and space Time Dependent Schrödinger Equation Probability from wavefunction The wavefunction does not have any physical interpretation. However : P(x, t) = (x, t)(x, t) dx * Probability density Is the probability at time t to find the particle between x and x + x. ( x, t)*( x, t)dx will change with time dx o x Time Dependent Schrödinger Equation Probability from wavefunction It is important to note that the particle is not distributed over a large region as a charge cloud (x,t)(x,t) * It is the probability patterns (wave function) used to describe the electron motion that behaves like waves and satisfies a wave equation Time Dependent Schrödinger Equation Probability from wavefunction Consider a large number N of identical boxes with identical particles all described by the same wavefunction (x,t) : Let dnx denote the number of particle which at the same time is found between x and x + x Then : dnx * (x, t) (x,t)dx N Time Dependent Schrödinger Equation with time independent potential energy The time - dependent Schroedinger equation : (x, t) (x, t) V(x, t)(x, t) 2 i t 2m x 2 2 V Can be simplified in those cases where the potential V only depends on the position : V(t,x) - > V(x) V(X) O Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space We might try to find a solution of the form: (x, t) f (t) (x) We have (x,t) ((x)f(t)) f(t) (x) t t t and 2 (x, t) 2 ((x)f(t)) 2 (x) f(t) 2 2 2 x x x Simplyfied Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space (x, t) (x, t) V(x, t)(x, t) 2 i t 2m x 2 2 A substitution of (x, t) f (t) (x) into the Schrödinger equation thus affords: 2 f(t) 2 (x) (x) f(t) V(x)f(t)(x) 2 i t 2m x Simplyfied Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space 2 f(t) 2 (x) (x) f(t) V(x)f(t)(x) 2 i t 2m x 1 A multiplication from the left by affords: f (t) (x) 1 f(t) 1 (x) V(x) 2 i f(t) t 2m (x) x 2 2 The R.H.S. does not depend on t if we now assume that V is time independent. Thus, the L.H.S. must also be independent of t Simplyfied Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space Thus : 1 f(t) E cons tant i f (t) t The L.H.S. does not depend on x so the R.H.S. must also be independent of x and equal to the same constant, E. 1 2 (x) V(x) E cons tan t 2 2m (x) x 2 Simplyfied Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space We can now solve for f(t) : 1 f(t) E cons tant i f (t) t Or : f(t) f (t) i Et Now integrating from time t=0 to t=to on both sides affords: to f(t) o f (t) to o i Et Simplyfied Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space to f(t) o f (t) to i Et o i ln[f(t o )] ln[f(o)] E[t o 0] i ln[ f (to )] Eto ln[ f (o)] i ln[ f (to )] Eto C Cons tant Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space i Or: ln[ f (to )] Eto C i i f (t) Exp Et C ExpCExp Et E E f (t) ExpC (cos t i sin t ) Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space E E f (t) ExpC (cos t i sin t ) + t 0 -i i - t ( / E) t ( / E) 2 i + 3 t ( /E) t 2( / E) 2 Change of sign of f(t) with time Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space Time independent Schrödinger equation The equation for (x) is given by 1 (x) V(x) E 2 2m (x) x 2 2 Or : (x) (x)V(x) E(x) 2 2m x 2 2 Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space Time independent Schrödinger equation (x) (x)V(x) E(x) 2 2m x 2 2 This is the time-independent Schroedinger Equation for a particle moving in the time independent potential V(x) It is a postulate of Quantum Mechanics that E is the total energy of the system Part of QM postulate 6 Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space Time independent Schrödinger equation The total wavefunction for a one-dimentional particle in a potential V(x) is given by (x, t) f (t) (x) Exp[C]Exp[i AExp[i E E t] (x) t] (x) Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space Time independent Schrödinger equation If (x) is a solution to (x) (x)V(x) E(x) 2 2m x 2 2 So is A (x) Lecture 2 (A(x)) A(x)V(x) AE(x) 2m x 2 2 2 Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space time independent probability function 2 (A(x)) A(x)V(x) AE(x) 2 2m x 2 or : '(x) '(x)V(x) E'(x) 2 2m x 2 2 with (x) = A (x) ' Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space time independent probability function Thus we can write without loss of generality for a particle in a time-independent potential (x, t) Exp[i E t] (x) This wavefunction is time dependent and complex. Let us now look at the corresponding probability density (x, t) (x, t) * Simplified Time Dependent Schrödinger Equation with time independent potential energy: separation of time and space time independent probability function We have : (x, t) (x, t) Exp[i * Exp[i E E t](x) t] (x) (x) (x) * * Thus , states describing systems with a time-independent potential V(x) have a time-independent (stationary) probability density. Simplified Time Dependent Schrödinger Equation stationary states (x, t) (x, t) Exp[i * Exp[i E E t](x) t] (x) (x) (x) * * This does not imply that the particle is stationary. However, it means that the probability of finding a particle in the interval x+ -1/2x to x + 1/2x is constant. Simplified Time Dependent Schrödinger Equation stationary states (x) (x)dx * Independent of time We say that systems that can be described by wave functions of the type (x, t) Exp[i Represent Stationary states E t] (x) Simplified Time Dependent Schrödinger Equation Postulate 6 The time development of the state of an undisturbed system is given by the time - dependent Schrödinger equation (x,t) ˆ H(x,t) i t ˆ is the Hamiltonian where H (i.e. energy) operator for the quantum mechanical system What you should know from this lecture 1. You should know postulate 6 and the form of the time dependent Schrödinger equation (x,t) ˆ H(x,t) i t 2. You should know that the wavefunction for systems where the potential energy is independent of time [V(x,t) V(x)] is given by E (x, t) Exp[i t](x) Where (x) is a solution to the time - independent Schrödinger equation : H(x) E(x), and E is the energy of the system. What you should know from this lecture 3. Systems with a time independent potential energy [V(x, t) V(x) ] have a time - independent probability density : E E * (x, t) (x,t) Exp[i t](x)Exp[i t] * (x) = (x) * (x). They are called stationary states