-------------------------------------------------------- The effective area-weighted free-energy-averaged (AW-FEA) solid-fluid potential for the 2D surface model corresponding to the BP-280 atomistic solid model; where z (left column) is the vertical distance to the basal plane of the 2D surface model. The potential (phi_AW-FEA) is calculated using a Lennard-Jones argon particle at 87.3 K. For z < 0.777 A, phi_AW-FEA goes to infinity due to the existence of the hard wall. --------------------------------------------------------- z [A] phi_AW-FEA [K] 0.777 -1811.75565 0.81105 -1709.57520 0.8451 -1667.19305 0.87915 -1638.40841 0.9132 -1616.72784 0.94725 -1594.99681 0.9813 -1566.44127 1.01535 -1527.27990 1.0494 -1495.29763 1.08345 -1480.69109 1.1175 -1474.84941 1.15155 -1466.02229 1.1856 -1454.83245 1.21965 -1441.70826 1.2537 -1426.97033 1.28775 -1410.79435 1.3218 -1393.65089 1.35585 -1375.70909 1.3899 -1356.93571 1.42395 -1337.81608 1.458 -1318.26418 1.49205 -1298.59892 1.5261 -1278.81066 1.56015 -1259.03119 1.5942 -1239.24026 1.62825 -1219.62644 1.6623 -1200.14170 1.69635 -1180.80980 1.7304 -1161.84915 1.76445 -1143.09018 1.7985 -1124.71459 1.83255 -1106.58367 1.8666 -1088.84816 1.90065 -1071.35368 1.9347 -1054.32939 1.96875 -1037.60987 2.0028 -1021.20825 2.03685 -1005.29271 2.0709 -989.662021 2.10495 -974.316782 2.139 -959.449712 2.17305 -945.041568 2.2071 -930.813484 2.24115 -916.966771 2.2752 -903.442658 2.30925 -890.319019 2.3433 -877.520202 2.37735 -865.054917 2.4114 -852.930362 2.44545 -840.991535 2.4795 -829.414628 2.51355 -818.088127 2.5476 -807.231992 2.58165 -796.582795 2.6157 -786.260339 2.64975 -776.141791 2.6838 -766.355474 2.71785 -756.794693 2.7519 -747.491311 2.78595 -738.485492 2.82 -729.808473 2.85405 -721.339785 2.8881 -713.062200 2.92215 -705.108457 2.9562 -697.409823 2.99025 -689.886029 3.0243 -682.691927 3.05835 -675.699665 3.0924 -668.896346 3.12645 -662.493384 3.1605 -656.247710 3.19455 -650.194331 3.2286 -644.349437 3.26265 -638.787308 3.2967 -633.462273 3.33075 -628.375103 3.3648 -623.563835 3.39885 -618.988879 3.4329 -614.703404 3.46695 -610.692206 3.501 -606.868036 3.53505 -603.552145 3.5691 -600.463588 3.60315 -597.734788 3.6372 -595.514701 3.67125 -593.668565 3.7053 -592.361898 3.73935 -591.616574 3.7734 -591.479473 3.80745 -591.874369 3.8415 -593.027108 3.87555 -594.827760 3.9096 -597.810938 3.94365 -604.548657 3.9777 -624.261961 4.01175 -670.781153 4.0458 -740.880410 4.07985 -815.412992 4.1139 -882.011443 4.14795 -936.178009 4.182 -977.461553 4.21605 -1006.60359 4.2501 -1024.66923 4.28415 -1032.44845 4.3182 -1030.08778 4.35225 -1014.51182 4.3863 -995.609736 4.42035 -980.524500 4.4544 -976.073300 4.48845 -968.606300 4.5225 -958.614600 4.55655 -946.504500 4.5906 -932.682900 4.62465 -917.434000 4.6587 -901.048000 4.69275 -883.787800 4.7268 -865.831500 4.76085 -847.361000 4.7949 -828.536300 4.82895 -809.486600 4.863 -790.312100 4.89705 -771.122900 4.9311 -751.990600 4.96515 -732.982400 4.9992 -714.159200 5.03325 -695.570300 5.0673 -677.242100 5.10135 -659.214500 5.1354 -641.527800 5.16945 -624.190400 5.2035 -607.202500 5.23755 -590.603700 5.2716 -574.391600 5.30565 -558.579700 5.3397 -543.153800 5.37375 -528.135200 5.4078 -513.512100 5.44185 -499.278300 5.4759 -485.453300 5.50995 -472.008800 5.544 -458.947100 5.57805 -446.270000 5.6121 -433.955500 5.64615 -422.019400 5.6802 -410.422600 5.71425 -399.182000 5.7483 -388.286800 5.78235 -377.717500 5.8164 -367.465200 5.85045 -357.539000 5.8845 -347.921600 5.91855 -338.592500 5.9526 -329.555000 5.98665 -320.800600 6.0207 -312.312600 6.05475 -304.095300 6.0888 -296.132200 6.12285 -288.416700 6.1569 -280.935500 6.19095 -273.693000 6.225 -266.670300 6.25905 -259.871200 6.2931 -253.276700 6.32715 -246.889000 6.3612 -240.698600 6.39525 -234.691600 6.4293 -228.872800 6.46335 -223.228300 6.4974 -217.759500 6.53145 -212.456000 6.5655 -207.302500 6.59955 -202.311800 6.6336 -197.470000 6.66765 -192.769600 6.7017 -188.208500 6.73575 -183.786400 6.7698 -179.488200 6.80385 -175.316200 6.8379 -171.266200 6.87195 -167.331500 6.906 -163.512400 6.94005 -159.798900 6.9741 -156.190900 7.00815 -152.686500 7.0422 -149.279000 7.07625 -145.969300 7.1103 -142.749000 7.14435 -139.616400 7.1784 -136.569900 7.21245 -133.608500 7.2465 -130.725500 7.28055 -127.920600 7.3146 -125.190900 7.34865 -122.533800 7.3827 -119.944700 7.41675 -117.427700 7.4508 -114.972700 7.48485 -112.583100 7.5189 -110.254300 7.55295 -107.986500 7.587 -105.774300 7.62105 -103.621100 7.6551 -101.520300 7.68915 -99.47185 7.7232 -97.47426 7.75725 -95.52529 7.7913 -93.62564 7.82535 -91.77129 7.8594 -89.96157 7.89345 -88.19767 7.9275 -86.47459 7.96155 -84.79271 7.9956 -83.14985 8.02965 -81.54560 8.0637 -79.97951 8.09775 -78.45196 8.1318 -76.95540 8.16585 -75.49640 8.1999 -74.06869 8.23395 -72.67443 8.268 -71.31278 8.30205 -69.98074 8.3361 -68.67835 8.37015 -67.40473 8.4042 -66.15986 8.43825 -64.94120 8.4723 -63.75006 8.50635 -62.58424 8.5404 -61.44318 8.57445 -60.32929 8.6085 -59.23670 8.64255 -58.16819 8.6766 -57.12201 8.71065 -56.09676 8.7447 -55.09448 8.77875 -54.11261 8.8128 -53.15155 8.84685 -52.20922 8.8809 -51.28656 8.91495 -50.38241 8.949 -49.49642 8.98305 -48.62959 9.0171 -47.77981 9.05115 -46.94619 9.0852 -46.12929 9.11925 -45.32906 9.1533 -44.54429 9.18735 -43.77526 9.2214 -43.01938 9.25545 -42.28020 9.2895 -41.55431 9.32355 -40.84347 9.3576 -40.14500 9.39165 -39.45950 9.4257 -38.78804 9.45975 -38.12880 9.4938 -37.48170 9.52785 -36.84750 9.5619 -36.22447 9.59595 -35.61304 9.63 -35.01258 9.66405 -34.42292 9.6981 -33.84479 9.73215 -33.27691 9.7662 -32.71880 9.80025 -32.17139 9.8343 -31.63384 9.86835 -31.10467 9.9024 -30.58622 9.93645 -30.07557 9.9705 -29.57565 10.00455 -29.08357 10.0386 -28.59976 10.07265 -28.12538 10.1067 -27.65811 10.14075 -27.19943 10.1748 -26.74916 10.20885 -26.30522 10.2429 -25.86979 10.27695 -25.44152 10.311 -25.02042 10.34505 -24.60648 10.3791 -24.19899 10.41315 -23.79900 10.4472 -23.40559 10.48125 -23.01863 10.5153 -22.63780 10.54935 -22.26282 10.5834 -21.89456 10.61745 -21.53273 10.6515 -21.17599 10.68555 -20.82556 10.7196 -20.48024 10.75365 -20.14059 10.7877 -19.80637 10.82175 -19.47795 10.8558 -19.15404 10.88985 -18.83575 10.9239 -18.52229 10.95795 -18.21347 10.992 -17.90994 11.02605 -17.61112 11.0601 -17.31676 11.09415 -17.02668 11.1282 -16.74136 11.16225 -16.46041 11.1963 -16.18345 11.23035 -15.91113 11.2644 -15.64302 11.29845 -15.37826 11.3325 -15.11803 11.36655 -14.88040 11.4006 -14.64794 11.43465 -14.41917 11.4687 -14.19397 11.50275 -13.97213 11.5368 -13.75361 11.57085 -13.53845 11.6049 -13.32644 11.63895 -13.11756 11.673 -12.91205 11.70705 -12.70940 11.7411 -12.50995 11.77515 -12.31339 11.8092 -12.11957 11.84325 -11.92888 11.8773 -11.74081 11.91135 -11.55576 11.9454 -11.37285 11.97945 -11.19314 12.0135 -11.01569 12.04755 -10.84104 12.0816 -10.66864 12.11565 -10.49910 12.1497 -10.33165 12.18375 -10.16672 12.2178 -10.00406 12.25185 -9.843867 12.2859 -9.685788 12.31995 -9.529843 12.354 -9.376305 12.38805 -9.224894 12.4221 -9.075508 12.45615 -8.928278 12.4902 -8.782996 12.52425 -8.639653 12.5583 -8.498579 12.59235 -8.359184 12.6264 -8.221903 12.66045 -8.086512 12.6945 -7.952693 12.72855 -7.820857 12.7626 -7.690777 12.79665 -7.562559 12.8307 -7.435986 12.86475 -7.311083 12.8988 -7.187774 12.93285 -7.066292 12.9669 -6.946394 13.00095 -6.827956 13.035 -6.711157 13.06905 -6.595948 13.1031 -6.482131 13.13715 -6.370023 13.1712 -6.259263 13.20525 -6.150018 13.2393 -6.042020 13.27335 -5.935552 13.3074 -5.830313 13.34145 -5.726715 13.3755 -5.624141 13.40955 -5.523076 13.4436 -5.423218 13.47765 -5.324780 13.5117 -5.227484 13.54575 -5.131443 13.5798 -5.036614 13.61385 -4.942850 13.6479 -4.850395 13.68195 -4.759148 13.716 -4.668959 13.75005 -4.579937 13.7841 -4.491936 13.81815 -4.405203 13.8522 -4.319397 13.88625 -4.234690 13.9203 -4.151061 13.95435 -4.068387 13.9884 -3.986847 14.02245 -3.906185 14.0565 -3.826521 14.09055 -3.747953 14.1246 -3.670201 14.15865 -3.593358 14.1927 -3.517561 14.22675 -3.442548 14.2608 -3.368555 14.29485 -3.295393 14.3289 -3.223202 14.36295 -3.151709 14.397 -3.081037 14.43105 -3.011492 14.4651 -2.942589 14.49915 -2.874440 14.5332 -2.807161 14.56725 -2.740723 14.6013 -2.674913 14.63535 -2.610008 14.6694 -2.545749 14.70345 -2.493290 14.7375 -2.450862 14.77155 -2.408985 14.8056 -2.367550 14.83965 -2.326761 14.8737 -2.286398 14.90775 -2.246503 14.9418 -2.207118 14.97585 -2.168190 15.0099 -2.129859 15.04395 -2.091823 15.078 -2.054352 15.11205 -2.017253 15.1461 -1.980694 15.18015 -1.944497 15.2142 -1.908781 15.24825 -1.873471 15.2823 -1.838618 15.31635 -1.804136 15.3504 -1.770083 15.38445 -1.736379 15.4185 -1.703120 15.45255 -1.670256 15.4866 -1.637749 15.52065 -1.605692 15.5547 -1.573899 15.58875 -1.542502 15.6228 -1.511528 15.65685 -1.480874 15.6909 -1.450631 15.72495 -1.420717 15.759 -1.391099 15.79305 -1.361843 15.8271 -1.332928 15.86115 -1.304332 15.8952 -1.276098 15.92925 -1.248127 15.9633 -1.220539 15.99735 -1.193219 16.0314 -1.166231 16.06545 -1.139516 16.0995 -1.113134 16.13355 -1.087028 16.1676 -1.061247 16.20165 -1.035708 16.2357 -1.010481 16.26975 -0.9855186 16.3038 -0.9608841 16.33785 -0.9364450 16.3719 -0.9123017 16.40595 -0.8884317 16.44 -0.8648581 16.47405 -0.8414921 16.5081 -0.8184146 16.54215 -0.7955950 16.5762 -0.7729492 16.61025 -0.7506634 16.6443 -0.7286647 16.67835 -0.7067003 16.7124 -0.6851184 16.74645 -0.6637002 16.7805 -0.6425820 16.81455 -0.6216141 16.8486 -0.6009092 16.88265 -0.5804139 16.9167 -0.5602252 16.95075 -0.5401133 16.9848 -0.5202197 17.01885 -0.5006071 17.0529 -0.4812015 17.08695 -0.4620449 17.121 -0.4430298 17.15505 -0.4242191 17.1891 -0.4056150 17.22315 -0.3871447 17.2572 -0.3689599 17.29125 -0.3509296 17.3253 -0.3330726 17.35935 -0.3154259 17.3934 -0.2979699 17.42745 -0.2806544 17.4615 -0.2635088 17.49555 -0.2465750 17.5296 -0.2298289 17.56365 -0.2132212 17.5977 -0.1967952 17.63175 -0.1805500 17.6658 -0.1644552 17.69985 -0.1485354 17.7339 -0.1327632 17.76795 -0.1171620 17.802 -0.1017224 17.83605 -0.0864263 17.8701 -0.0712940 17.90415 -0.0563152 17.9382 -0.0414815 17.97225 -0.0268000 18.0063 -0.0122649 18.04035 0.000000