From c7fe425ef3c5e8804f2f5de3d8fffedf5e2f1131 Mon Sep 17 00:00:00 2001 From: hardythe1 Date: Tue, 7 Apr 2015 15:58:05 +0530 Subject: added books --- Physical_Chemsitry/Chapter17.ipynb | 183 +++++++++++++++++++++++++++++++++++++ 1 file changed, 183 insertions(+) create mode 100755 Physical_Chemsitry/Chapter17.ipynb (limited to 'Physical_Chemsitry/Chapter17.ipynb') diff --git a/Physical_Chemsitry/Chapter17.ipynb b/Physical_Chemsitry/Chapter17.ipynb new file mode 100755 index 00000000..6e295125 --- /dev/null +++ b/Physical_Chemsitry/Chapter17.ipynb @@ -0,0 +1,183 @@ +{ + "metadata": { + "name": "", + "signature": "sha256:4d58417f5757dcfb290ed1ee0e2191d724d6d044069d2c21c72e96a05505c726" + }, + "nbformat": 3, + "nbformat_minor": 0, + "worksheets": [ + { + "cells": [ + { + "cell_type": "heading", + "level": 1, + "metadata": {}, + "source": [ + "Chapter 17 - Resolving Kinetic data" + ] + }, + { + "cell_type": "heading", + "level": 2, + "metadata": {}, + "source": [ + "Example 1 - pg 446" + ] + }, + { + "cell_type": "code", + "collapsed": false, + "input": [ + "#calculate the Order of the reaction\n", + "#Initialization of variablesx1=5\n", + "import math\n", + "from math import log\n", + "x2=20.\n", + "x1=5.\n", + "n1=7.49\n", + "n2=5.14\n", + "#calculations\n", + "n=(log(n1)-log(n2))/(log(100-x1) - log(100-x2))\n", + "#results\n", + "print '%s %.2f' %(\"Order of the reaction = \",n)\n" + ], + "language": "python", + "metadata": {}, + "outputs": [ + { + "output_type": "stream", + "stream": "stdout", + "text": [ + "Order of the reaction = 2.19\n" + ] + } + ], + "prompt_number": 1 + }, + { + "cell_type": "heading", + "level": 2, + "metadata": {}, + "source": [ + "Example 2 - pg 448" + ] + }, + { + "cell_type": "code", + "collapsed": false, + "input": [ + "#calculate the Order of the reaction\n", + "#Initialization of variablesx1=5\n", + "import math\n", + "from math import log\n", + "p2=169.\n", + "p1=363.\n", + "t1=410.\n", + "t2=880.\n", + "#calculations\n", + "ndash=(log(t2) - log(t1))/(log(p1) - log(p2))\n", + "n=ndash+1\n", + "#results\n", + "print '%s %.2f' %(\"Order of the reaction = \",n)\n" + ], + "language": "python", + "metadata": {}, + "outputs": [ + { + "output_type": "stream", + "stream": "stdout", + "text": [ + "Order of the reaction = 2.00\n" + ] + } + ], + "prompt_number": 2 + }, + { + "cell_type": "heading", + "level": 2, + "metadata": {}, + "source": [ + "Example 3 - pg 454" + ] + }, + { + "cell_type": "code", + "collapsed": false, + "input": [ + "#calculate the Activation energy and Z\n", + "#Initialization of variables\n", + "import math\n", + "R=1.987 #cal/deg/mol\n", + "k1=4.45*10**-5\n", + "k2=2.52*10**-6\n", + "T1=283+273.2 #K\n", + "T2=356+273.2 #K\n", + "#calculations\n", + "Ea=2.303*R*1.7530 /(1/T1 - 1/T2)\n", + "logZ= math.log10(k1) +Ea/(2.303*R*T1)\n", + "Z=10**logZ\n", + "#results\n", + "print '%s %d %s' %(\"Activation energy =\",Ea,\"cal/mol\")\n", + "print '%s %.1e %s' %(\"\\n Z =\",Z,\"lt /mol sec\")\n" + ], + "language": "python", + "metadata": {}, + "outputs": [ + { + "output_type": "stream", + "stream": "stdout", + "text": [ + "Activation energy = 38456 cal/mol\n", + "\n", + " Z = 5.7e+10 lt /mol sec\n" + ] + } + ], + "prompt_number": 3 + }, + { + "cell_type": "heading", + "level": 2, + "metadata": {}, + "source": [ + "Example 5 - pg 456" + ] + }, + { + "cell_type": "code", + "collapsed": false, + "input": [ + "#calculate the Equlibrium constant\n", + "#Initialization of variables\n", + "g1=0.661\n", + "g2=0.899\n", + "g3=0.405\n", + "g4=0.803\n", + "g5=0.946\n", + "g6=0.614\n", + "k=1.33\n", + "#calculations\n", + "k0=k*g3/(g1*g2)\n", + "k2=k0*g4*g5/g6\n", + "#results\n", + "print '%s %.2f %s' %(\"Equlibrium constant =\",k2,\"lt/mol min\")\n" + ], + "language": "python", + "metadata": {}, + "outputs": [ + { + "output_type": "stream", + "stream": "stdout", + "text": [ + "Equlibrium constant = 1.12 lt/mol min\n" + ] + } + ], + "prompt_number": 4 + } + ], + "metadata": {} + } + ] +} \ No newline at end of file -- cgit